4-[4-[4-(3-chlorophenyl)piperazin-1-yl]butyl]-2,3-dihydro-1,4-benzoxazepin-5-one

Systemtic Name: 4-[4-[4-(3-chlorophenyl)piperazin-1-yl]butyl]-2,3-dihydro-1,4-benzoxazepin-5-one Openeye Name: 4-[4-[4-(3-chlorophenyl)piperazin-1-yl]butyl]-2,3-dihydro-1,4-benzoxazepin-5-one CAS Name: 4-[4-[4-(3-chlorophenyl)-1-piperazinyl]butyl]-2,3-dihydro-1,4-benzoxazepin-5-one IUPAC Name: 4-[4-[4-(3-chlorophenyl)piperazin-1-yl]butyl]-2,3-dihydro-1,4-benzoxazepin-5-one Traditional Name: 4-[4-[4-(3-chlorophenyl)piperazino]butyl]-2,3-dihydro-1,4-benzoxazepin-5-one Formula: C23H28ClN3O2 MolecularWeight: 413.94032

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2CCOC3=CC=CC=C3C2=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1CCCCN2CCOC3=CC=CC=C3C2=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H28ClN3O2/c24-19-6-5-7-20(18-19)26-14-12-25(13-15-26)10-3-4-11-27-16-17-29-22-9-2-1-8-21(22)23(27)28/h1-2,5-9,18H,3-4,10-17H2