2-(1,3-benzodioxol-5-ylmethyl)-N-[(4-methylphenyl)sulfonylmethyl]-3-oxidanylidene-1H-isoindole-1-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-[(4-methylphenyl)sulfonylmethyl]-3-oxidanylidene-1H-isoindole-1-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-oxo-N-(p-tolylsulfonylmethyl)isoindoline-1-carboxamide CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-[(4-methylphenyl)sulfonylmethyl]-3-oxo-1H-isoindole-1-carboxamide IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-[(4-methylphenyl)sulfonylmethyl]-3-oxo-1H-isoindole-1-carboxamide Traditional Name: 3-keto-2-piperonyl-N-(tosylmethyl)isoindoline-1-carboxamide Formula: C25H22N2O6S MolecularWeight: 478.51698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CNC(=O)C2C3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CNC(=O)C2C3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H22N2O6S/c1-16-6-9-18(10-7-16)34(30,31)14-26-24(28)23-19-4-2-3-5-20(19)25(29)27(23)13-17-8-11-21-22(12-17)33-15-32-21/h2-12,23H,13-15H2,1H3,(H,26,28)