4-[2-[(4-fluoranylphenoxy)-pyridin-3-yl-amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[2-[(4-fluoranylphenoxy)-pyridin-3-yl-amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[2-[(4-fluorophenoxy)-(3-pyridyl)amino]-2-oxo-ethyl]cyclohexanecarboxylic acid CAS Name: 4-[2-[(4-fluorophenoxy)-(3-pyridinyl)amino]-2-oxoethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[2-[(4-fluorophenoxy)-pyridin-3-ylamino]-2-oxoethyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[2-[(4-fluorophenoxy)-(3-pyridyl)amino]-2-keto-ethyl]cyclohexanecarboxylic acid Formula: C20H21FN2O4 MolecularWeight: 372.390143

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CC(=O)N(C2=CN=CC=C2)OC3=CC=C(C=C3)F)C(=O)O

Isomeric SMILES

C1CC(CCC1CC(=O)N(C2=CN=CC=C2)OC3=CC=C(C=C3)F)C(=O)O

InChI

InChI=1S/C20H21FN2O4/c21-16-7-9-18(10-8-16)27-23(17-2-1-11-22-13-17)19(24)12-14-3-5-15(6-4-14)20(25)26/h1-2,7-11,13-15H,3-6,12H2,(H,25,26)