7-methyl-2-(4-methylphenyl)-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindole-4-carboxylic acid

Systemtic Name: 7-methyl-2-(4-methylphenyl)-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindole-4-carboxylic acid Openeye Name: 7-methyl-1,3-dioxo-2-(p-tolyl)-3a,4,7,7a-tetrahydroisoindole-4-carboxylic acid CAS Name: 7-methyl-2-(4-methylphenyl)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindole-4-carboxylic acid IUPAC Name: 7-methyl-2-(4-methylphenyl)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindole-4-carboxylic acid Traditional Name: 1,3-diketo-7-methyl-2-(p-tolyl)-3a,4,7,7a-tetrahydroisoindole-4-carboxylic acid Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC(C2C1C(=O)N(C2=O)C3=CC=C(C=C3)C)C(=O)O

Isomeric SMILES

CC1C=CC(C2C1C(=O)N(C2=O)C3=CC=C(C=C3)C)C(=O)O

InChI

InChI=1S/C17H17NO4/c1-9-3-6-11(7-4-9)18-15(19)13-10(2)5-8-12(17(21)22)14(13)16(18)20/h3-8,10,12-14H,1-2H3,(H,21,22)