3-[(3-cyclopentyloxy-4-methoxy-phenyl)-(5-fluoranylpyridin-3-yl)carbonyl-amino]benzoic acid

Systemtic Name: 3-[(3-cyclopentyloxy-4-methoxy-phenyl)-(5-fluoranylpyridin-3-yl)carbonyl-amino]benzoic acid Openeye Name: 3-[3-(cyclopentoxy)-N-(5-fluoropyridine-3-carbonyl)-4-methoxy-anilino]benzoic acid CAS Name: 3-(3-cyclopentyloxy-N-[(5-fluoro-3-pyridinyl)-oxomethyl]-4-methoxyanilino)benzoic acid IUPAC Name: 3-(3-cyclopentyloxy-N-(5-fluoropyridine-3-carbonyl)-4-methoxyanilino)benzoic acid Traditional Name: 3-[3-(cyclopentoxy)-N-(5-fluoronicotinoyl)-4-methoxy-anilino]benzoic acid Formula: C25H23FN2O5 MolecularWeight: 450.458923

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(C2=CC=CC(=C2)C(=O)O)C(=O)C3=CC(=CN=C3)F)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)N(C2=CC=CC(=C2)C(=O)O)C(=O)C3=CC(=CN=C3)F)OC4CCCC4

InChI

InChI=1S/C25H23FN2O5/c1-32-22-10-9-20(13-23(22)33-21-7-2-3-8-21)28(19-6-4-5-16(12-19)25(30)31)24(29)17-11-18(26)15-27-14-17/h4-6,9-15,21H,2-3,7-8H2,1H3,(H,30,31)