methyl 3-[[6-[(4-ethanoyl-2-ethyl-5-oxidanyl-phenoxy)methyl]pyridin-2-yl]carbonylamino]-4-oxidanyl-butanoate

Systemtic Name: methyl 3-[[6-[(4-ethanoyl-2-ethyl-5-oxidanyl-phenoxy)methyl]pyridin-2-yl]carbonylamino]-4-oxidanyl-butanoate Openeye Name: methyl 3-[[6-[(4-acetyl-2-ethyl-5-hydroxy-phenoxy)methyl]pyridine-2-carbonyl]amino]-4-hydroxy-butanoate CAS Name: 3-[[[6-[(4-acetyl-2-ethyl-5-hydroxyphenoxy)methyl]-2-pyridinyl]-oxomethyl]amino]-4-hydroxybutanoic acid methyl ester IUPAC Name: methyl 3-[[6-[(4-acetyl-2-ethyl-5-hydroxyphenoxy)methyl]pyridine-2-carbonyl]amino]-4-hydroxybutanoate Traditional Name: 3-[[6-[(4-acetyl-2-ethyl-5-hydroxy-phenoxy)methyl]picolinoyl]amino]-4-hydroxy-butyric acid methyl ester Formula: C22H26N2O7 MolecularWeight: 430.45104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C(=O)C)O)OCC2=CC=CC(=N2)C(=O)NC(CC(=O)OC)CO

Isomeric SMILES

CCC1=C(C=C(C(=C1)C(=O)C)O)OCC2=CC=CC(=N2)C(=O)NC(CC(=O)OC)CO

InChI

InChI=1S/C22H26N2O7/c1-4-14-8-17(13(2)26)19(27)10-20(14)31-12-15-6-5-7-18(23-15)22(29)24-16(11-25)9-21(28)30-3/h5-8,10,16,25,27H,4,9,11-12H2,1-3H3,(H,24,29)