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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCC(C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCC(C)C

InChI

InChI=1S/C21H22N2O3/c1-13(2)10-11-22-19(24)15-8-9-16-17(12-15)21(26)23(20(16)25)18-7-5-4-6-14(18)3/h4-9,12-13H,10-11H2,1-3H3,(H,22,24)