methyl 4-[4-(2-oxidanylidenepyrrolidin-1-yl)-2-(trifluoromethyl)phenyl]benzoate

Systemtic Name: methyl 4-[4-(2-oxidanylidenepyrrolidin-1-yl)-2-(trifluoromethyl)phenyl]benzoate Openeye Name: methyl 4-[4-(2-oxopyrrolidin-1-yl)-2-(trifluoromethyl)phenyl]benzoate CAS Name: 4-[4-(2-oxo-1-pyrrolidinyl)-2-(trifluoromethyl)phenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(2-oxopyrrolidin-1-yl)-2-(trifluoromethyl)phenyl]benzoate Traditional Name: 4-[4-(2-ketopyrrolidino)-2-(trifluoromethyl)phenyl]benzoic acid methyl ester Formula: C19H16F3NO3 MolecularWeight: 363.33045

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)N3CCCC3=O)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)N3CCCC3=O)C(F)(F)F

InChI

InChI=1S/C19H16F3NO3/c1-26-18(25)13-6-4-12(5-7-13)15-9-8-14(11-16(15)19(20,21)22)23-10-2-3-17(23)24/h4-9,11H,2-3,10H2,1H3