1-(4-cyanophenyl)-5-(4-ethanoylphenyl)-3-(1H-indol-3-ylmethyl)-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 1-(4-cyanophenyl)-5-(4-ethanoylphenyl)-3-(1H-indol-3-ylmethyl)-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-(4-acetylphenyl)-1-(4-cyanophenyl)-3-(1H-indol-3-ylmethyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 5-(4-acetylphenyl)-1-(4-cyanophenyl)-3-(1H-indol-3-ylmethyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 5-(4-acetylphenyl)-1-(4-cyanophenyl)-3-(1H-indol-3-ylmethyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 5-(4-acetylphenyl)-1-(4-cyanophenyl)-3-(1H-indol-3-ylmethyl)-4,6-diketo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C31H24N4O5 MolecularWeight: 532.54606

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C(=O)C3C(C2=O)C(NC3C4=CC=C(C=C4)C#N)(CC5=CNC6=CC=CC=C65)C(=O)O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C(=O)C3C(C2=O)C(NC3C4=CC=C(C=C4)C#N)(CC5=CNC6=CC=CC=C65)C(=O)O

InChI

InChI=1S/C31H24N4O5/c1-17(36)19-10-12-22(13-11-19)35-28(37)25-26(29(35)38)31(30(39)40,14-21-16-33-24-5-3-2-4-23(21)24)34-27(25)20-8-6-18(15-32)7-9-20/h2-13,16,25-27,33-34H,14H2,1H3,(H,39,40)