methyl 2-[(4-methoxy-3-oxidanyl-pyridin-2-yl)carbonylamino]-3-(3-phenylpropanoyloxy)propanoate

Systemtic Name: methyl 2-[(4-methoxy-3-oxidanyl-pyridin-2-yl)carbonylamino]-3-(3-phenylpropanoyloxy)propanoate Openeye Name: methyl 2-[(3-hydroxy-4-methoxy-pyridine-2-carbonyl)amino]-3-(3-phenylpropanoyloxy)propanoate CAS Name: 2-[[(3-hydroxy-4-methoxy-2-pyridinyl)-oxomethyl]amino]-3-(1-oxo-3-phenylpropoxy)propanoic acid methyl ester IUPAC Name: methyl 2-[(3-hydroxy-4-methoxypyridine-2-carbonyl)amino]-3-(3-phenylpropanoyloxy)propanoate Traditional Name: 3-hydrocinnamoyloxy-2-[(3-hydroxy-4-methoxy-picolinoyl)amino]propionic acid methyl ester Formula: C20H22N2O7 MolecularWeight: 402.39788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=NC=C1)C(=O)NC(COC(=O)CCC2=CC=CC=C2)C(=O)OC)O

Isomeric SMILES

COC1=C(C(=NC=C1)C(=O)NC(COC(=O)CCC2=CC=CC=C2)C(=O)OC)O

InChI

InChI=1S/C20H22N2O7/c1-27-15-10-11-21-17(18(15)24)19(25)22-14(20(26)28-2)12-29-16(23)9-8-13-6-4-3-5-7-13/h3-7,10-11,14,24H,8-9,12H2,1-2H3,(H,22,25)