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

Systemtic Name: 1-(4-cyanophenyl)-3-(1H-indol-3-ylmethyl)-5-(3-nitrophenyl)-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 1-(4-cyanophenyl)-3-(1H-indol-3-ylmethyl)-5-(3-nitrophenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 1-(4-cyanophenyl)-3-(1H-indol-3-ylmethyl)-5-(3-nitrophenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 1-(4-cyanophenyl)-3-(1H-indol-3-ylmethyl)-5-(3-nitrophenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 1-(4-cyanophenyl)-3-(1H-indol-3-ylmethyl)-4,6-diketo-5-(3-nitrophenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C29H21N5O6 MolecularWeight: 535.50694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC3(C4C(C(N3)C5=CC=C(C=C5)C#N)C(=O)N(C4=O)C6=CC(=CC=C6)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC3(C4C(C(N3)C5=CC=C(C=C5)C#N)C(=O)N(C4=O)C6=CC(=CC=C6)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C29H21N5O6/c30-14-16-8-10-17(11-9-16)25-23-24(27(36)33(26(23)35)19-4-3-5-20(12-19)34(39)40)29(32-25,28(37)38)13-18-15-31-22-7-2-1-6-21(18)22/h1-12,15,23-25,31-32H,13H2,(H,37,38)