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

Systemtic Name: 5-(naphthalen-1-ylmethyl)-3-[(4-nitrophenyl)methyl]-4,6-bis(oxidanylidene)-1-[3-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-(1-naphthylmethyl)-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: 5-(1-naphthalenylmethyl)-3-[(4-nitrophenyl)methyl]-4,6-dioxo-1-[3-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 5-(naphthalen-1-ylmethyl)-3-[(4-nitrophenyl)methyl]-4,6-dioxo-1-[3-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 4,6-diketo-5-(1-naphthylmethyl)-3-(4-nitrobenzyl)-1-[3-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C32H24F3N3O6 MolecularWeight: 603.54467

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CN3C(=O)C4C(C3=O)C(NC4C5=CC(=CC=C5)C(F)(F)F)(CC6=CC=C(C=C6)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CN3C(=O)C4C(C3=O)C(NC4C5=CC(=CC=C5)C(F)(F)F)(CC6=CC=C(C=C6)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C32H24F3N3O6/c33-32(34,35)22-9-4-7-20(15-22)27-25-26(31(36-27,30(41)42)16-18-11-13-23(14-12-18)38(43)44)29(40)37(28(25)39)17-21-8-3-6-19-5-1-2-10-24(19)21/h1-15,25-27,36H,16-17H2,(H,41,42)