(2S)-2-(3,4-dimethoxyphenyl)-3-pyridin-2-yl-propanoic acid

Systemtic Name: (2S)-2-(3,4-dimethoxyphenyl)-3-pyridin-2-yl-propanoic acid Openeye Name: (2S)-2-(3,4-dimethoxyphenyl)-3-(2-pyridyl)propanoic acid CAS Name: (2S)-2-(3,4-dimethoxyphenyl)-3-(2-pyridinyl)propanoic acid IUPAC Name: (2S)-2-(3,4-dimethoxyphenyl)-3-pyridin-2-ylpropanoic acid Traditional Name: (2S)-2-(3,4-dimethoxyphenyl)-3-(2-pyridyl)propionic acid Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC2=CC=CC=N2)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H](CC2=CC=CC=N2)C(=O)O)OC

InChI

InChI=1S/C16H17NO4/c1-20-14-7-6-11(9-15(14)21-2)13(16(18)19)10-12-5-3-4-8-17-12/h3-9,13H,10H2,1-2H3,(H,18,19)/t13-/m0/s1