Ταυτότητα

Econazole EP Impurity C

Δεν αναφέρεται · C25H21Cl5N2O

01Ταυτότητα

Lazychem ID	LC-35449
CAS RN	Δεν αναφέρεται
PubChem CID	129318614
Molecular formula	C25H21Cl5N2O
Molecular weight	542.7 g/mol
IUPAC name	1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]-3-[(4-chlorophenyl)methyl]imidazol-3-ium chloride
InChIKey	ATUHLWDQURJFAF-UHFFFAOYSA-M

02Δομή και στερεοχημεία

Two-dimensional chemical structure of Econazole EP Impurity C — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 4 rings, includes aromatic atoms, includes aliphatic carbon, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres	0
Ring count	4
Secondary amines	0
Tertiary amines	0

SMILES	C1=CC(=CC=C1C[N+]2=CN(C=C2)CC(C3=C(C=C(C=C3)Cl)Cl)OCC4=CC=C(C=C4)Cl)Cl.[Cl-]
InChI	Δεν αναφέρεται

03Stereochemistry

The published structure contains 0 defined and 1 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.

Defined centres0Structure assigned

Unassigned centres1Structure unspecified

Assignment statusUnassignedExact published identity

Tetrahedral upper bound≤ 2Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.