7-chloranyl-1-(2-dimethylaminoethyl)-5,5-diphenyl-4,1-benzoxazepin-2-one hydrochloride

Systemtic Name: 7-chloranyl-1-(2-dimethylaminoethyl)-5,5-diphenyl-4,1-benzoxazepin-2-one hydrochloride Openeye Name: 7-chloro-1-(2-dimethylaminoethyl)-5,5-diphenyl-4,1-benzoxazepin-2-one hydrochloride CAS Name: 7-chloro-1-(2-dimethylaminoethyl)-5,5-diphenyl-4,1-benzoxazepin-2-one hydrochloride IUPAC Name: 7-chloro-1-(2-dimethylaminoethyl)-5,5-diphenyl-4,1-benzoxazepin-2-one hydrochloride Traditional Name: 7-chloro-1-(2-dimethylaminoethyl)-5,5-diphenyl-4,1-benzoxazepin-2-one hydrochloride Formula: C25H26Cl2N2O2 MolecularWeight: 457.39214

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C(=O)COC(C2=C1C=CC(=C2)Cl)(C3=CC=CC=C3)C4=CC=CC=C4.Cl

Isomeric SMILES

CN(C)CCN1C(=O)COC(C2=C1C=CC(=C2)Cl)(C3=CC=CC=C3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C25H25ClN2O2.ClH/c1-27(2)15-16-28-23-14-13-21(26)17-22(23)25(30-18-24(28)29,19-9-5-3-6-10-19)20-11-7-4-8-12-20;/h3-14,17H,15-16,18H2,1-2H3;1H