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

Systemtic Name: 3-[[6-(cyclopropylmethoxy)-5-methoxy-pyridin-2-yl]-(pyridin-3-ylmethyl)amino]benzoic acid Openeye Name: 3-[[6-(cyclopropylmethoxy)-5-methoxy-2-pyridyl]-(3-pyridylmethyl)amino]benzoic acid CAS Name: 3-[[6-(cyclopropylmethoxy)-5-methoxy-2-pyridinyl]-(3-pyridinylmethyl)amino]benzoic acid IUPAC Name: 3-[[6-(cyclopropylmethoxy)-5-methoxypyridin-2-yl]-(pyridin-3-ylmethyl)amino]benzoic acid Traditional Name: 3-[[6-(cyclopropylmethoxy)-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)OCC4CC4

Isomeric SMILES

COC1=C(N=C(C=C1)N(CC2=CN=CC=C2)C3=CC=CC(=C3)C(=O)O)OCC4CC4

InChI

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