N-[3-(2-methylpiperidin-1-yl)propyl]-3-oxidanylidene-2-(phenylmethyl)-1H-isoindole-5-carboxamide

Systemtic Name: N-[3-(2-methylpiperidin-1-yl)propyl]-3-oxidanylidene-2-(phenylmethyl)-1H-isoindole-5-carboxamide Openeye Name: 2-benzyl-N-[3-(2-methyl-1-piperidyl)propyl]-3-oxo-isoindoline-5-carboxamide CAS Name: N-[3-(2-methyl-1-piperidinyl)propyl]-3-oxo-2-(phenylmethyl)-1H-isoindole-5-carboxamide IUPAC Name: 2-benzyl-N-[3-(2-methylpiperidin-1-yl)propyl]-3-oxo-1H-isoindole-5-carboxamide Traditional Name: 2-benzyl-3-keto-N-[3-(2-methylpiperidino)propyl]isoindoline-5-carboxamide Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNC(=O)C2=CC3=C(CN(C3=O)CC4=CC=CC=C4)C=C2

Isomeric SMILES

CC1CCCCN1CCCNC(=O)C2=CC3=C(CN(C3=O)CC4=CC=CC=C4)C=C2

InChI

InChI=1S/C25H31N3O2/c1-19-8-5-6-14-27(19)15-7-13-26-24(29)21-11-12-22-18-28(25(30)23(22)16-21)17-20-9-3-2-4-10-20/h2-4,9-12,16,19H,5-8,13-15,17-18H2,1H3,(H,26,29)