6-(3-chlorophenyl)-1-(1-phenyl-2-pyrrolidin-1-yl-ethyl)-5,6-dihydro-2H-azepin-7-one

Systemtic Name: 6-(3-chlorophenyl)-1-(1-phenyl-2-pyrrolidin-1-yl-ethyl)-5,6-dihydro-2H-azepin-7-one Openeye Name: 6-(3-chlorophenyl)-1-(1-phenyl-2-pyrrolidin-1-yl-ethyl)-5,6-dihydro-2H-azepin-7-one CAS Name: 6-(3-chlorophenyl)-1-[1-phenyl-2-(1-pyrrolidinyl)ethyl]-5,6-dihydro-2H-azepin-7-one IUPAC Name: 6-(3-chlorophenyl)-1-(1-phenyl-2-pyrrolidin-1-ylethyl)-5,6-dihydro-2H-azepin-7-one Traditional Name: 6-(3-chlorophenyl)-1-(1-phenyl-2-pyrrolidino-ethyl)-5,6-dihydro-2H-azepin-7-one Formula: C24H27ClN2O MolecularWeight: 394.93698

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(C2=CC=CC=C2)N3CC=CCC(C3=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CCN(C1)CC(C2=CC=CC=C2)N3CC=CCC(C3=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H27ClN2O/c25-21-12-8-11-20(17-21)22-13-4-5-16-27(24(22)28)23(18-26-14-6-7-15-26)19-9-2-1-3-10-19/h1-5,8-12,17,22-23H,6-7,13-16,18H2