3-(4-ethoxy-3-methoxy-phenyl)-3-(pyridin-3-ylcarbonylamino)propanoic acid

Systemtic Name: 3-(4-ethoxy-3-methoxy-phenyl)-3-(pyridin-3-ylcarbonylamino)propanoic acid Openeye Name: 3-(4-ethoxy-3-methoxy-phenyl)-3-(pyridine-3-carbonylamino)propanoic acid CAS Name: 3-(4-ethoxy-3-methoxyphenyl)-3-[[oxo(3-pyridinyl)methyl]amino]propanoic acid IUPAC Name: 3-(4-ethoxy-3-methoxyphenyl)-3-(pyridine-3-carbonylamino)propanoic acid Traditional Name: 3-(4-ethoxy-3-methoxy-phenyl)-3-nicotinamido-propionic acid Formula: C18H20N2O5 MolecularWeight: 344.3618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(CC(=O)O)NC(=O)C2=CN=CC=C2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(CC(=O)O)NC(=O)C2=CN=CC=C2)OC

InChI

InChI=1S/C18H20N2O5/c1-3-25-15-7-6-12(9-16(15)24-2)14(10-17(21)22)20-18(23)13-5-4-8-19-11-13/h4-9,11,14H,3,10H2,1-2H3,(H,20,23)(H,21,22)