N-[2-[4-(diphenylmethyl)piperazin-1-yl]ethyl]-2,3,4,5-tetrahydro-1H-2-benzazepine-8-carboxamide

Systemtic Name: N-[2-[4-(diphenylmethyl)piperazin-1-yl]ethyl]-2,3,4,5-tetrahydro-1H-2-benzazepine-8-carboxamide Openeye Name: N-[2-(4-benzhydrylpiperazin-1-yl)ethyl]-2,3,4,5-tetrahydro-1H-2-benzazepine-8-carboxamide CAS Name: N-[2-[4-(diphenylmethyl)-1-piperazinyl]ethyl]-2,3,4,5-tetrahydro-1H-2-benzazepine-8-carboxamide IUPAC Name: N-[2-(4-benzhydrylpiperazin-1-yl)ethyl]-2,3,4,5-tetrahydro-1H-2-benzazepine-8-carboxamide Traditional Name: N-[2-(4-benzhydrylpiperazino)ethyl]-2,3,4,5-tetrahydro-1H-2-benzazepine-8-carboxamide Formula: C30H36N4O MolecularWeight: 468.63304

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CNC1)C=C(C=C2)C(=O)NCCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC2=C(CNC1)C=C(C=C2)C(=O)NCCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H36N4O/c35-30(27-14-13-24-12-7-15-31-23-28(24)22-27)32-16-17-33-18-20-34(21-19-33)29(25-8-3-1-4-9-25)26-10-5-2-6-11-26/h1-6,8-11,13-14,22,29,31H,7,12,15-21,23H2,(H,32,35)