(3S)-1-[1,3-bis(oxidanylidene)-2-(quinolin-3-ylmethyl)isoindol-4-yl]-N-cyclohexyl-N-methyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-[1,3-bis(oxidanylidene)-2-(quinolin-3-ylmethyl)isoindol-4-yl]-N-cyclohexyl-N-methyl-piperidine-3-carboxamide Openeye Name: (3S)-N-cyclohexyl-1-[1,3-dioxo-2-(3-quinolylmethyl)isoindolin-4-yl]-N-methyl-piperidine-3-carboxamide CAS Name: (3S)-N-cyclohexyl-1-[1,3-dioxo-2-(3-quinolinylmethyl)-4-isoindolyl]-N-methyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-cyclohexyl-1-[1,3-dioxo-2-(quinolin-3-ylmethyl)isoindol-4-yl]-N-methylpiperidine-3-carboxamide Traditional Name: (3S)-N-cyclohexyl-1-[1,3-diketo-2-(3-quinolylmethyl)isoindolin-4-yl]-N-methyl-nipecotamide Formula: C31H34N4O3 MolecularWeight: 510.62666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)C2CCCN(C2)C3=CC=CC4=C3C(=O)N(C4=O)CC5=CC6=CC=CC=C6N=C5

Isomeric SMILES

CN(C1CCCCC1)C(=O)[C@H]2CCCN(C2)C3=CC=CC4=C3C(=O)N(C4=O)CC5=CC6=CC=CC=C6N=C5

InChI

InChI=1S/C31H34N4O3/c1-33(24-11-3-2-4-12-24)29(36)23-10-8-16-34(20-23)27-15-7-13-25-28(27)31(38)35(30(25)37)19-21-17-22-9-5-6-14-26(22)32-18-21/h5-7,9,13-15,17-18,23-24H,2-4,8,10-12,16,19-20H2,1H3/t23-/m0/s1