2-(1,3-benzodioxol-5-ylmethyl)-N-(2,3-dimethylcyclohexyl)-3-oxidanylidene-1H-isoindole-1-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-(2,3-dimethylcyclohexyl)-3-oxidanylidene-1H-isoindole-1-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-(2,3-dimethylcyclohexyl)-3-oxo-isoindoline-1-carboxamide CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-(2,3-dimethylcyclohexyl)-3-oxo-1H-isoindole-1-carboxamide IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-(2,3-dimethylcyclohexyl)-3-oxo-1H-isoindole-1-carboxamide Traditional Name: N-(2,3-dimethylcyclohexyl)-3-keto-2-piperonyl-isoindoline-1-carboxamide Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C2C3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1CCCC(C1C)NC(=O)C2C3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H28N2O4/c1-15-6-5-9-20(16(15)2)26-24(28)23-18-7-3-4-8-19(18)25(29)27(23)13-17-10-11-21-22(12-17)31-14-30-21/h3-4,7-8,10-12,15-16,20,23H,5-6,9,13-14H2,1-2H3,(H,26,28)