3-(carboxymethyl)-1-(3,5-dimethoxy-2-methoxycarbonyl-phenyl)-5-(4-ethanoylphenyl)-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 3-(carboxymethyl)-1-(3,5-dimethoxy-2-methoxycarbonyl-phenyl)-5-(4-ethanoylphenyl)-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-(4-acetylphenyl)-3-(carboxymethyl)-1-(3,5-dimethoxy-2-methoxycarbonyl-phenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 5-(4-acetylphenyl)-3-(carboxymethyl)-1-(3,5-dimethoxy-2-methoxycarbonylphenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 5-(4-acetylphenyl)-3-(carboxymethyl)-1-(3,5-dimethoxy-2-methoxycarbonylphenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 5-(4-acetylphenyl)-1-(2-carbomethoxy-3,5-dimethoxy-phenyl)-3-(carboxymethyl)-4,6-diketo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C27H26N2O11 MolecularWeight: 554.50214

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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(=CC(=C4C(=O)OC)OC)OC)(CC(=O)O)C(=O)O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C(=O)C3C(C2=O)C(NC3C4=CC(=CC(=C4C(=O)OC)OC)OC)(CC(=O)O)C(=O)O

InChI

InChI=1S/C27H26N2O11/c1-12(30)13-5-7-14(8-6-13)29-23(33)20-21(24(29)34)27(26(36)37,11-18(31)32)28-22(20)16-9-15(38-2)10-17(39-3)19(16)25(35)40-4/h5-10,20-22,28H,11H2,1-4H3,(H,31,32)(H,36,37)