3-[(6-cyclobutyloxy-5-methoxy-pyridin-2-yl)-(pyridin-3-ylmethyl)amino]benzoic acid

Systemtic Name: 3-[(6-cyclobutyloxy-5-methoxy-pyridin-2-yl)-(pyridin-3-ylmethyl)amino]benzoic acid Openeye Name: 3-[[6-(cyclobutoxy)-5-methoxy-2-pyridyl]-(3-pyridylmethyl)amino]benzoic acid CAS Name: 3-[(6-cyclobutyloxy-5-methoxy-2-pyridinyl)-(3-pyridinylmethyl)amino]benzoic acid IUPAC Name: 3-[(6-cyclobutyloxy-5-methoxypyridin-2-yl)-(pyridin-3-ylmethyl)amino]benzoic acid Traditional Name: 3-[[6-(cyclobutoxy)-5-methoxy-2-pyridyl]-(3-pyridylmethyl)amino]benzoic acid Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N=C(C=C1)N(CC2=CN=CC=C2)C3=CC=CC(=C3)C(=O)O)OC4CCC4

Isomeric SMILES

COC1=C(N=C(C=C1)N(CC2=CN=CC=C2)C3=CC=CC(=C3)C(=O)O)OC4CCC4

InChI

InChI=1S/C23H23N3O4/c1-29-20-10-11-21(25-22(20)30-19-8-3-9-19)26(15-16-5-4-12-24-14-16)18-7-2-6-17(13-18)23(27)28/h2,4-7,10-14,19H,3,8-9,15H2,1H3,(H,27,28)