1-(4-bromophenyl)-4,6-bis(oxidanylidene)-3-(phenylmethyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 1-(4-bromophenyl)-4,6-bis(oxidanylidene)-3-(phenylmethyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 3-benzyl-1-(4-bromophenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 1-(4-bromophenyl)-4,6-dioxo-3-(phenylmethyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 3-benzyl-1-(4-bromophenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 3-benzyl-1-(4-bromophenyl)-4,6-diketo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C20H17BrN2O4 MolecularWeight: 429.26398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2(C3C(C(N2)C4=CC=C(C=C4)Br)C(=O)NC3=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2(C3C(C(N2)C4=CC=C(C=C4)Br)C(=O)NC3=O)C(=O)O

InChI

InChI=1S/C20H17BrN2O4/c21-13-8-6-12(7-9-13)16-14-15(18(25)22-17(14)24)20(23-16,19(26)27)10-11-4-2-1-3-5-11/h1-9,14-16,23H,10H2,(H,26,27)(H,22,24,25)