5-(2,6-diethylphenyl)-1-(3-methoxy-4-oxidanyl-phenyl)-3-methyl-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 5-(2,6-diethylphenyl)-1-(3-methoxy-4-oxidanyl-phenyl)-3-methyl-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-(2,6-diethylphenyl)-1-(4-hydroxy-3-methoxy-phenyl)-3-methyl-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 5-(2,6-diethylphenyl)-1-(4-hydroxy-3-methoxyphenyl)-3-methyl-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 5-(2,6-diethylphenyl)-1-(4-hydroxy-3-methoxyphenyl)-3-methyl-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 5-(2,6-diethylphenyl)-1-(4-hydroxy-3-methoxy-phenyl)-4,6-diketo-3-methyl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C25H28N2O6 MolecularWeight: 452.49962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)N2C(=O)C3C(C2=O)C(NC3C4=CC(=C(C=C4)O)OC)(C)C(=O)O

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)N2C(=O)C3C(C2=O)C(NC3C4=CC(=C(C=C4)O)OC)(C)C(=O)O

InChI

InChI=1S/C25H28N2O6/c1-5-13-8-7-9-14(6-2)21(13)27-22(29)18-19(23(27)30)25(3,24(31)32)26-20(18)15-10-11-16(28)17(12-15)33-4/h7-12,18-20,26,28H,5-6H2,1-4H3,(H,31,32)