2-[[4-(6-methoxypyridin-3-yl)-2-(trifluoromethyl)phenyl]carbamoyl]cyclopentene-1-carboxylic acid

Systemtic Name: 2-[[4-(6-methoxypyridin-3-yl)-2-(trifluoromethyl)phenyl]carbamoyl]cyclopentene-1-carboxylic acid Openeye Name: 2-[[4-(6-methoxy-3-pyridyl)-2-(trifluoromethyl)phenyl]carbamoyl]cyclopentene-1-carboxylic acid CAS Name: 2-[[4-(6-methoxy-3-pyridinyl)-2-(trifluoromethyl)anilino]-oxomethyl]-1-cyclopentenecarboxylic acid IUPAC Name: 2-[[4-(6-methoxypyridin-3-yl)-2-(trifluoromethyl)phenyl]carbamoyl]cyclopentene-1-carboxylic acid Traditional Name: 2-[[4-(6-methoxy-3-pyridyl)-2-(trifluoromethyl)phenyl]carbamoyl]cyclopentene-1-carboxylic acid Formula: C20H17F3N2O4 MolecularWeight: 406.35519

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)C2=CC(=C(C=C2)NC(=O)C3=C(CCC3)C(=O)O)C(F)(F)F

Isomeric SMILES

COC1=NC=C(C=C1)C2=CC(=C(C=C2)NC(=O)C3=C(CCC3)C(=O)O)C(F)(F)F

InChI

InChI=1S/C20H17F3N2O4/c1-29-17-8-6-12(10-24-17)11-5-7-16(15(9-11)20(21,22)23)25-18(26)13-3-2-4-14(13)19(27)28/h5-10H,2-4H2,1H3,(H,25,26)(H,27,28)