5-(2-hydroxyethyl)-1-(4-methoxycarbonylphenyl)-3-(naphthalen-2-ylmethyl)-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 5-(2-hydroxyethyl)-1-(4-methoxycarbonylphenyl)-3-(naphthalen-2-ylmethyl)-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-(2-hydroxyethyl)-1-(4-methoxycarbonylphenyl)-3-(2-naphthylmethyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 5-(2-hydroxyethyl)-1-(4-methoxycarbonylphenyl)-3-(2-naphthalenylmethyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 5-(2-hydroxyethyl)-1-(4-methoxycarbonylphenyl)-3-(naphthalen-2-ylmethyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 1-(4-carbomethoxyphenyl)-5-(2-hydroxyethyl)-4,6-diketo-3-(2-naphthylmethyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C28H26N2O7 MolecularWeight: 502.51524

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2C3C(C(=O)N(C3=O)CCO)C(N2)(CC4=CC5=CC=CC=C5C=C4)C(=O)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2C3C(C(=O)N(C3=O)CCO)C(N2)(CC4=CC5=CC=CC=C5C=C4)C(=O)O

InChI

InChI=1S/C28H26N2O7/c1-37-26(34)19-10-8-18(9-11-19)23-21-22(25(33)30(12-13-31)24(21)32)28(29-23,27(35)36)15-16-6-7-17-4-2-3-5-20(17)14-16/h2-11,14,21-23,29,31H,12-13,15H2,1H3,(H,35,36)