3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-1-methyl-4,5-dihydro-3H-1-benzazepin-2-one

Systemtic Name: 3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-1-methyl-4,5-dihydro-3H-1-benzazepin-2-one Openeye Name: 3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-1-methyl-4,5-dihydro-3H-1-benzazepin-2-one CAS Name: 3-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-1-methyl-4,5-dihydro-3H-1-benzazepin-2-one IUPAC Name: 3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-1-methyl-4,5-dihydro-3H-1-benzazepin-2-one Traditional Name: 3-[4-(4-chlorobenzyl)piperazino]-1-methyl-4,5-dihydro-3H-1-benzazepin-2-one Formula: C22H26ClN3O MolecularWeight: 383.91434

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2CCC(C1=O)N3CCN(CC3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C2=CC=CC=C2CCC(C1=O)N3CCN(CC3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H26ClN3O/c1-24-20-5-3-2-4-18(20)8-11-21(22(24)27)26-14-12-25(13-15-26)16-17-6-9-19(23)10-7-17/h2-7,9-10,21H,8,11-16H2,1H3