5-ethyl-1-(2-methylphenyl)-3-(2-methylpropyl)-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 5-ethyl-1-(2-methylphenyl)-3-(2-methylpropyl)-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-ethyl-3-isobutyl-1-(o-tolyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 5-ethyl-1-(2-methylphenyl)-3-(2-methylpropyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 5-ethyl-1-(2-methylphenyl)-3-(2-methylpropyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 5-ethyl-3-isobutyl-4,6-diketo-1-(o-tolyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C20H26N2O4 MolecularWeight: 358.43144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2C(C1=O)C(NC2C3=CC=CC=C3C)(CC(C)C)C(=O)O

Isomeric SMILES

CCN1C(=O)C2C(C1=O)C(NC2C3=CC=CC=C3C)(CC(C)C)C(=O)O

InChI

InChI=1S/C20H26N2O4/c1-5-22-17(23)14-15(18(22)24)20(19(25)26,10-11(2)3)21-16(14)13-9-7-6-8-12(13)4/h6-9,11,14-16,21H,5,10H2,1-4H3,(H,25,26)