Ταυτότητα

Metoprolol IMpurity 12

Δεν αναφέρεται · C27H42ClNO6

01Ταυτότητα

Lazychem ID	LC-36282
CAS RN	Δεν αναφέρεται
PubChem CID	117064500
Molecular formula	C27H42ClNO6
Molecular weight	512.1 g/mol
IUPAC name	1-[[2-hydroxy-3-[4-(2-methoxyethyl)phenoxy]propyl]-propan-2-ylamino]-3-[4-(2-methoxyethyl)phenoxy]propan-2-ol;hydrochloride
InChIKey	DLLKKRCTYCMVLB-UHFFFAOYSA-N

02Δομή και στερεοχημεία

Two-dimensional chemical structure of Metoprolol IMpurity 12 — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 2 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	2
Secondary amines	0
Tertiary amines	1

SMILES	CC(C)N(CC(COC1=CC=C(C=C1)CCOC)O)CC(COC2=CC=C(C=C2)CCOC)O.Cl
InChI	Δεν αναφέρεται

03Stereochemistry

The published structure contains 0 defined and 2 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres0Structure assigned

Unassigned centres2Structure unspecified

Assignment statusUnassignedExact published identity

Tetrahedral upper bound≤ 4Before symmetry reduction

Published same-connectivity configurations

2 records

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.