2-(1,3-benzodioxol-5-ylmethyl)-N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-3-oxidanylidene-1H-isoindole-1-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-3-oxidanylidene-1H-isoindole-1-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-[3-(2,6-dimethyl-1-piperidyl)propyl]-3-oxo-isoindoline-1-carboxamide CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-[3-(2,6-dimethyl-1-piperidinyl)propyl]-3-oxo-1H-isoindole-1-carboxamide IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-3-oxo-1H-isoindole-1-carboxamide Traditional Name: N-[3-(2,6-dimethylpiperidino)propyl]-3-keto-2-piperonyl-isoindoline-1-carboxamide Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1CCCNC(=O)C2C3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CC1CCCC(N1CCCNC(=O)C2C3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5)C

InChI

InChI=1S/C27H33N3O4/c1-18-7-5-8-19(2)29(18)14-6-13-28-26(31)25-21-9-3-4-10-22(21)27(32)30(25)16-20-11-12-23-24(15-20)34-17-33-23/h3-4,9-12,15,18-19,25H,5-8,13-14,16-17H2,1-2H3,(H,28,31)