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

Systemtic Name: 5-(3-chloranyl-4-methyl-phenyl)-3-(1-hydroxyethyl)-4,6-bis(oxidanylidene)-1-[3-(trifluoromethyloxy)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-(3-chloro-4-methyl-phenyl)-3-(1-hydroxyethyl)-4,6-dioxo-1-[3-(trifluoromethoxy)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 5-(3-chloro-4-methylphenyl)-3-(1-hydroxyethyl)-4,6-dioxo-1-[3-(trifluoromethoxy)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 5-(3-chloro-4-methylphenyl)-3-(1-hydroxyethyl)-4,6-dioxo-1-[3-(trifluoromethoxy)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 5-(3-chloro-4-methyl-phenyl)-3-(1-hydroxyethyl)-4,6-diketo-1-[3-(trifluoromethoxy)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C23H20ClF3N2O6 MolecularWeight: 512.86291

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3C(C2=O)C(NC3C4=CC(=CC=C4)OC(F)(F)F)(C(C)O)C(=O)O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3C(C2=O)C(NC3C4=CC(=CC=C4)OC(F)(F)F)(C(C)O)C(=O)O)Cl

InChI

InChI=1S/C23H20ClF3N2O6/c1-10-6-7-13(9-15(10)24)29-19(31)16-17(20(29)32)22(11(2)30,21(33)34)28-18(16)12-4-3-5-14(8-12)35-23(25,26)27/h3-9,11,16-18,28,30H,1-2H3,(H,33,34)