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

Systemtic Name: 3-butyl-4,6-bis(oxidanylidene)-1-[4-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 3-butyl-4,6-dioxo-1-[4-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 3-butyl-4,6-dioxo-1-[4-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 3-butyl-4,6-dioxo-1-[4-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 3-butyl-4,6-diketo-1-[4-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C18H19F3N2O4 MolecularWeight: 384.34967

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C2C(C(N1)C3=CC=C(C=C3)C(F)(F)F)C(=O)NC2=O)C(=O)O

Isomeric SMILES

CCCCC1(C2C(C(N1)C3=CC=C(C=C3)C(F)(F)F)C(=O)NC2=O)C(=O)O

InChI

InChI=1S/C18H19F3N2O4/c1-2-3-8-17(16(26)27)12-11(14(24)22-15(12)25)13(23-17)9-4-6-10(7-5-9)18(19,20)21/h4-7,11-13,23H,2-3,8H2,1H3,(H,26,27)(H,22,24,25)