2-(3-aminophenyl)-N-[4-[4-[2-oxidanylidene-1-phenyl-2-[(phenylmethyl)amino]ethyl]piperidin-1-yl]phenyl]benzamide

Systemtic Name: 2-(3-aminophenyl)-N-[4-[4-[2-oxidanylidene-1-phenyl-2-[(phenylmethyl)amino]ethyl]piperidin-1-yl]phenyl]benzamide Openeye Name: 2-(3-aminophenyl)-N-[4-[4-[2-(benzylamino)-2-oxo-1-phenyl-ethyl]-1-piperidyl]phenyl]benzamide CAS Name: 2-(3-aminophenyl)-N-[4-[4-[2-oxo-1-phenyl-2-[(phenylmethyl)amino]ethyl]-1-piperidinyl]phenyl]benzamide IUPAC Name: 2-(3-aminophenyl)-N-[4-[4-[2-(benzylamino)-2-oxo-1-phenylethyl]piperidin-1-yl]phenyl]benzamide Traditional Name: 2-(3-aminophenyl)-N-[4-[4-[2-(benzylamino)-2-keto-1-phenyl-ethyl]piperidino]phenyl]benzamide Formula: C39H38N4O2 MolecularWeight: 594.74462

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(C2=CC=CC=C2)C(=O)NCC3=CC=CC=C3)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5C6=CC(=CC=C6)N

Isomeric SMILES

C1CN(CCC1C(C2=CC=CC=C2)C(=O)NCC3=CC=CC=C3)C4=CC=C(C=C4)NC(=O)C5=CC=CC=C5C6=CC(=CC=C6)N

InChI

InChI=1S/C39H38N4O2/c40-32-15-9-14-31(26-32)35-16-7-8-17-36(35)38(44)42-33-18-20-34(21-19-33)43-24-22-30(23-25-43)37(29-12-5-2-6-13-29)39(45)41-27-28-10-3-1-4-11-28/h1-21,26,30,37H,22-25,27,40H2,(H,41,45)(H,42,44)