3-(hydroxymethyl)-4,6-bis(oxidanylidene)-5-(2-phenylazanylethyl)-1-(4-phenylphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 3-(hydroxymethyl)-4,6-bis(oxidanylidene)-5-(2-phenylazanylethyl)-1-(4-phenylphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-(2-anilinoethyl)-3-(hydroxymethyl)-4,6-dioxo-1-(4-phenylphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 5-(2-anilinoethyl)-3-(hydroxymethyl)-4,6-dioxo-1-(4-phenylphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 5-(2-anilinoethyl)-3-(hydroxymethyl)-4,6-dioxo-1-(4-phenylphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 5-(2-anilinoethyl)-4,6-diketo-3-methylol-1-(4-phenylphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C28H27N3O5 MolecularWeight: 485.53108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3C4C(C(=O)N(C4=O)CCNC5=CC=CC=C5)C(N3)(CO)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3C4C(C(=O)N(C4=O)CCNC5=CC=CC=C5)C(N3)(CO)C(=O)O

InChI

InChI=1S/C28H27N3O5/c32-17-28(27(35)36)23-22(25(33)31(26(23)34)16-15-29-21-9-5-2-6-10-21)24(30-28)20-13-11-19(12-14-20)18-7-3-1-4-8-18/h1-14,22-24,29-30,32H,15-17H2,(H,35,36)