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

Systemtic Name: 3-(2-methylpropyl)-1-naphthalen-2-yl-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 3-isobutyl-1-(2-naphthyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 3-(2-methylpropyl)-1-(2-naphthalenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 3-(2-methylpropyl)-1-naphthalen-2-yl-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 3-isobutyl-4,6-diketo-1-(2-naphthyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C21H22N2O4 MolecularWeight: 366.41038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(C2C(C(N1)C3=CC4=CC=CC=C4C=C3)C(=O)NC2=O)C(=O)O

Isomeric SMILES

CC(C)CC1(C2C(C(N1)C3=CC4=CC=CC=C4C=C3)C(=O)NC2=O)C(=O)O

InChI

InChI=1S/C21H22N2O4/c1-11(2)10-21(20(26)27)16-15(18(24)22-19(16)25)17(23-21)14-8-7-12-5-3-4-6-13(12)9-14/h3-9,11,15-17,23H,10H2,1-2H3,(H,26,27)(H,22,24,25)