3-[(4-nitrophenyl)methyl]-4,6-bis(oxidanylidene)-5-(3-phenylprop-2-enyl)-1-[3-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 3-[(4-nitrophenyl)methyl]-4,6-bis(oxidanylidene)-5-(3-phenylprop-2-enyl)-1-[3-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-cinnamyl-3-[(4-nitrophenyl)methyl]-4,6-dioxo-1-[3-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 3-[(4-nitrophenyl)methyl]-4,6-dioxo-5-(3-phenylprop-2-enyl)-1-[3-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 3-[(4-nitrophenyl)methyl]-4,6-dioxo-5-(3-phenylprop-2-enyl)-1-[3-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 5-cinnamyl-4,6-diketo-3-(4-nitrobenzyl)-1-[3-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C30H24F3N3O6 MolecularWeight: 579.52327

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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=C4)C(F)(F)F)(CC5=CC=C(C=C5)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C=CCN2C(=O)C3C(C2=O)C(NC3C4=CC(=CC=C4)C(F)(F)F)(CC5=CC=C(C=C5)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C30H24F3N3O6/c31-30(32,33)21-10-4-9-20(16-21)25-23-24(27(38)35(26(23)37)15-5-8-18-6-2-1-3-7-18)29(34-25,28(39)40)17-19-11-13-22(14-12-19)36(41)42/h1-14,16,23-25,34H,15,17H2,(H,39,40)