3-[(3-cyclopentyloxy-4-fluoranyl-phenyl)-(pyridin-3-ylmethyl)amino]benzoic acid

Systemtic Name: 3-[(3-cyclopentyloxy-4-fluoranyl-phenyl)-(pyridin-3-ylmethyl)amino]benzoic acid Openeye Name: 3-[3-(cyclopentoxy)-4-fluoro-N-(3-pyridylmethyl)anilino]benzoic acid CAS Name: 3-[3-cyclopentyloxy-4-fluoro-N-(3-pyridinylmethyl)anilino]benzoic acid IUPAC Name: 3-[3-cyclopentyloxy-4-fluoro-N-(pyridin-3-ylmethyl)anilino]benzoic acid Traditional Name: 3-[3-(cyclopentoxy)-4-fluoro-N-(3-pyridylmethyl)anilino]benzoic acid Formula: C24H23FN2O3 MolecularWeight: 406.449423

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC2=C(C=CC(=C2)N(CC3=CN=CC=C3)C4=CC=CC(=C4)C(=O)O)F

Isomeric SMILES

C1CCC(C1)OC2=C(C=CC(=C2)N(CC3=CN=CC=C3)C4=CC=CC(=C4)C(=O)O)F

InChI

InChI=1S/C24H23FN2O3/c25-22-11-10-20(14-23(22)30-21-8-1-2-9-21)27(16-17-5-4-12-26-15-17)19-7-3-6-18(13-19)24(28)29/h3-7,10-15,21H,1-2,8-9,16H2,(H,28,29)