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

Systemtic Name: 5-methyl-4,6-bis(oxidanylidene)-3-(phenylmethoxymethyl)-1-[4-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 3-(benzyloxymethyl)-5-methyl-4,6-dioxo-1-[4-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 5-methyl-4,6-dioxo-3-(phenylmethoxymethyl)-1-[4-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 5-methyl-4,6-dioxo-3-(phenylmethoxymethyl)-1-[4-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 3-(benzoxymethyl)-4,6-diketo-5-methyl-1-[4-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C23H21F3N2O5 MolecularWeight: 462.41845

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2C(C1=O)C(NC2C3=CC=C(C=C3)C(F)(F)F)(COCC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CN1C(=O)C2C(C1=O)C(NC2C3=CC=C(C=C3)C(F)(F)F)(COCC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C23H21F3N2O5/c1-28-19(29)16-17(20(28)30)22(21(31)32,12-33-11-13-5-3-2-4-6-13)27-18(16)14-7-9-15(10-8-14)23(24,25)26/h2-10,16-18,27H,11-12H2,1H3,(H,31,32)