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

Systemtic Name: 3-(carboxymethyl)-1-(2-cyanophenyl)-4,6-bis(oxidanylidene)-5-(3-phenylprop-2-enyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 3-(carboxymethyl)-5-cinnamyl-1-(2-cyanophenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 3-(carboxymethyl)-1-(2-cyanophenyl)-4,6-dioxo-5-(3-phenylprop-2-enyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 3-(carboxymethyl)-1-(2-cyanophenyl)-4,6-dioxo-5-(3-phenylprop-2-enyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 3-(carboxymethyl)-5-cinnamyl-1-(2-cyanophenyl)-4,6-diketo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C25H21N3O6 MolecularWeight: 459.45074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCN2C(=O)C3C(C2=O)C(NC3C4=CC=CC=C4C#N)(CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C=CCN2C(=O)C3C(C2=O)C(NC3C4=CC=CC=C4C#N)(CC(=O)O)C(=O)O

InChI

InChI=1S/C25H21N3O6/c26-14-16-10-4-5-11-17(16)21-19-20(25(27-21,24(33)34)13-18(29)30)23(32)28(22(19)31)12-6-9-15-7-2-1-3-8-15/h1-11,19-21,27H,12-13H2,(H,29,30)(H,33,34)