4-[(3-cyclopropyloxy-4-methoxy-phenyl)-(pyridin-3-ylmethyl)amino]benzoic acid

Systemtic Name: 4-[(3-cyclopropyloxy-4-methoxy-phenyl)-(pyridin-3-ylmethyl)amino]benzoic acid Openeye Name: 4-[3-(cyclopropoxy)-4-methoxy-N-(3-pyridylmethyl)anilino]benzoic acid CAS Name: 4-[3-cyclopropyloxy-4-methoxy-N-(3-pyridinylmethyl)anilino]benzoic acid IUPAC Name: 4-[3-cyclopropyloxy-4-methoxy-N-(pyridin-3-ylmethyl)anilino]benzoic acid Traditional Name: 4-[3-(cyclopropoxy)-4-methoxy-N-(3-pyridylmethyl)anilino]benzoic acid Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC2=CN=CC=C2)C3=CC=C(C=C3)C(=O)O)OC4CC4

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC2=CN=CC=C2)C3=CC=C(C=C3)C(=O)O)OC4CC4

InChI

InChI=1S/C23H22N2O4/c1-28-21-11-8-19(13-22(21)29-20-9-10-20)25(15-16-3-2-12-24-14-16)18-6-4-17(5-7-18)23(26)27/h2-8,11-14,20H,9-10,15H2,1H3,(H,26,27)