3-(1H-indol-3-ylmethyl)-1-(3-methoxy-2-oxidanyl-phenyl)-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 3-(1H-indol-3-ylmethyl)-1-(3-methoxy-2-oxidanyl-phenyl)-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 1-(2-hydroxy-3-methoxy-phenyl)-3-(1H-indol-3-ylmethyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 1-(2-hydroxy-3-methoxyphenyl)-3-(1H-indol-3-ylmethyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 1-(2-hydroxy-3-methoxyphenyl)-3-(1H-indol-3-ylmethyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 1-(2-hydroxy-3-methoxy-phenyl)-3-(1H-indol-3-ylmethyl)-4,6-diketo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C23H21N3O6 MolecularWeight: 435.42934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1O)C2C3C(C(=O)NC3=O)C(N2)(CC4=CNC5=CC=CC=C54)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1O)C2C3C(C(=O)NC3=O)C(N2)(CC4=CNC5=CC=CC=C54)C(=O)O

InChI

InChI=1S/C23H21N3O6/c1-32-15-8-4-6-13(19(15)27)18-16-17(21(29)25-20(16)28)23(26-18,22(30)31)9-11-10-24-14-7-3-2-5-12(11)14/h2-8,10,16-18,24,26-27H,9H2,1H3,(H,30,31)(H,25,28,29)