3-(carboxymethyl)-5-(2,6-diethylphenyl)-4,6-bis(oxidanylidene)-1-(4-propoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 3-(carboxymethyl)-5-(2,6-diethylphenyl)-4,6-bis(oxidanylidene)-1-(4-propoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 3-(carboxymethyl)-5-(2,6-diethylphenyl)-4,6-dioxo-1-(4-propoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 3-(carboxymethyl)-5-(2,6-diethylphenyl)-4,6-dioxo-1-(4-propoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 3-(carboxymethyl)-5-(2,6-diethylphenyl)-4,6-dioxo-1-(4-propoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 3-(carboxymethyl)-5-(2,6-diethylphenyl)-4,6-diketo-1-(4-propoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C28H32N2O7 MolecularWeight: 508.56288

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2C3C(C(=O)N(C3=O)C4=C(C=CC=C4CC)CC)C(N2)(CC(=O)O)C(=O)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2C3C(C(=O)N(C3=O)C4=C(C=CC=C4CC)CC)C(N2)(CC(=O)O)C(=O)O

InChI

InChI=1S/C28H32N2O7/c1-4-14-37-19-12-10-18(11-13-19)23-21-22(28(29-23,27(35)36)15-20(31)32)26(34)30(25(21)33)24-16(5-2)8-7-9-17(24)6-3/h7-13,21-23,29H,4-6,14-15H2,1-3H3,(H,31,32)(H,35,36)