3-chloranyl-4-[(3-cyclopentyloxy-4-methoxy-phenyl)-pyridin-3-ylcarbonyl-amino]benzoic acid

Systemtic Name: 3-chloranyl-4-[(3-cyclopentyloxy-4-methoxy-phenyl)-pyridin-3-ylcarbonyl-amino]benzoic acid Openeye Name: 3-chloro-4-[3-(cyclopentoxy)-4-methoxy-N-(pyridine-3-carbonyl)anilino]benzoic acid CAS Name: 3-chloro-4-(3-cyclopentyloxy-4-methoxy-N-[oxo(3-pyridinyl)methyl]anilino)benzoic acid IUPAC Name: 3-chloro-4-[3-cyclopentyloxy-4-methoxy-N-(pyridine-3-carbonyl)anilino]benzoic acid Traditional Name: 3-chloro-4-[3-(cyclopentoxy)-4-methoxy-N-nicotinoyl-anilino]benzoic acid Formula: C25H23ClN2O5 MolecularWeight: 466.91352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23ClN2O5/c1-32-22-11-9-18(14-23(22)33-19-6-2-3-7-19)28(24(29)17-5-4-12-27-15-17)21-10-8-16(25(30)31)13-20(21)26/h4-5,8-15,19H,2-3,6-7H2,1H3,(H,30,31)