1-(2,4-dimethoxy-3-methyl-phenyl)-3-(hydroxymethyl)-5-(3-nitrophenyl)-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 1-(2,4-dimethoxy-3-methyl-phenyl)-3-(hydroxymethyl)-5-(3-nitrophenyl)-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 1-(2,4-dimethoxy-3-methyl-phenyl)-3-(hydroxymethyl)-5-(3-nitrophenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 1-(2,4-dimethoxy-3-methylphenyl)-3-(hydroxymethyl)-5-(3-nitrophenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 1-(2,4-dimethoxy-3-methylphenyl)-3-(hydroxymethyl)-5-(3-nitrophenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 1-(2,4-dimethoxy-3-methyl-phenyl)-4,6-diketo-3-methylol-5-(3-nitrophenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C23H23N3O9 MolecularWeight: 485.44342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OC)C2C3C(C(=O)N(C3=O)C4=CC(=CC=C4)[N+](=O)[O-])C(N2)(CO)C(=O)O)OC

Isomeric SMILES

CC1=C(C=CC(=C1OC)C2C3C(C(=O)N(C3=O)C4=CC(=CC=C4)[N+](=O)[O-])C(N2)(CO)C(=O)O)OC

InChI

InChI=1S/C23H23N3O9/c1-11-15(34-2)8-7-14(19(11)35-3)18-16-17(23(10-27,24-18)22(30)31)21(29)25(20(16)28)12-5-4-6-13(9-12)26(32)33/h4-9,16-18,24,27H,10H2,1-3H3,(H,30,31)