2-(2-methylphenyl)-1,3-bis(oxidanylidene)-N-pentyl-isoindole-5-carboxamide

Systemtic Name: 2-(2-methylphenyl)-1,3-bis(oxidanylidene)-N-pentyl-isoindole-5-carboxamide Openeye Name: 2-(o-tolyl)-1,3-dioxo-N-pentyl-isoindoline-5-carboxamide CAS Name: 2-(2-methylphenyl)-1,3-dioxo-N-pentyl-5-isoindolecarboxamide IUPAC Name: 2-(2-methylphenyl)-1,3-dioxo-N-pentylisoindole-5-carboxamide Traditional Name: N-amyl-1,3-diketo-2-(o-tolyl)isoindoline-5-carboxamide Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=CC=C3C

Isomeric SMILES

CCCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=CC=C3C

InChI

InChI=1S/C21H22N2O3/c1-3-4-7-12-22-19(24)15-10-11-16-17(13-15)21(26)23(20(16)25)18-9-6-5-8-14(18)2/h5-6,8-11,13H,3-4,7,12H2,1-2H3,(H,22,24)