5-oxidanylidene-1-[3-[(phenylmethyl)carbamoylamino]-5-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylic acid

Systemtic Name: 5-oxidanylidene-1-[3-[(phenylmethyl)carbamoylamino]-5-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylic acid Openeye Name: 1-[3-(benzylcarbamoylamino)-5-(trifluoromethyl)phenyl]-5-oxo-pyrrolidine-3-carboxylic acid CAS Name: 5-oxo-1-[3-[[oxo-[(phenylmethyl)amino]methyl]amino]-5-(trifluoromethyl)phenyl]-3-pyrrolidinecarboxylic acid IUPAC Name: 1-[3-(benzylcarbamoylamino)-5-(trifluoromethyl)phenyl]-5-oxopyrrolidine-3-carboxylic acid Traditional Name: 1-[3-(benzylcarbamoylamino)-5-(trifluoromethyl)phenyl]-5-keto-pyrrolidine-3-carboxylic acid Formula: C20H18F3N3O4 MolecularWeight: 421.36983

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC(=CC(=C2)C(F)(F)F)NC(=O)NCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1C(CN(C1=O)C2=CC(=CC(=C2)C(F)(F)F)NC(=O)NCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H18F3N3O4/c21-20(22,23)14-7-15(25-19(30)24-10-12-4-2-1-3-5-12)9-16(8-14)26-11-13(18(28)29)6-17(26)27/h1-5,7-9,13H,6,10-11H2,(H,28,29)(H2,24,25,30)