2-[(4-methoxy-3-oxidanyl-pyridin-2-yl)carbonylamino]-3-(4-phenylmethoxyphenyl)propanoic acid

Systemtic Name: 2-[(4-methoxy-3-oxidanyl-pyridin-2-yl)carbonylamino]-3-(4-phenylmethoxyphenyl)propanoic acid Openeye Name: 3-(4-benzyloxyphenyl)-2-[(3-hydroxy-4-methoxy-pyridine-2-carbonyl)amino]propanoic acid CAS Name: 2-[[(3-hydroxy-4-methoxy-2-pyridinyl)-oxomethyl]amino]-3-(4-phenylmethoxyphenyl)propanoic acid IUPAC Name: 2-[(3-hydroxy-4-methoxypyridine-2-carbonyl)amino]-3-(4-phenylmethoxyphenyl)propanoic acid Traditional Name: 3-(4-benzoxyphenyl)-2-[(3-hydroxy-4-methoxy-picolinoyl)amino]propionic acid Formula: C23H22N2O6 MolecularWeight: 422.43058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=NC=C1)C(=O)NC(CC2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)O)O

Isomeric SMILES

COC1=C(C(=NC=C1)C(=O)NC(CC2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)O)O

InChI

InChI=1S/C23H22N2O6/c1-30-19-11-12-24-20(21(19)26)22(27)25-18(23(28)29)13-15-7-9-17(10-8-15)31-14-16-5-3-2-4-6-16/h2-12,18,26H,13-14H2,1H3,(H,25,27)(H,28,29)