methyl 3-[2-(5-decoxy-6-methanoyl-pyridin-2-yl)-1-oxidanyl-ethyl]benzoate

Systemtic Name: methyl 3-[2-(5-decoxy-6-methanoyl-pyridin-2-yl)-1-oxidanyl-ethyl]benzoate Openeye Name: methyl 3-[2-(5-decoxy-6-formyl-2-pyridyl)-1-hydroxy-ethyl]benzoate CAS Name: 3-[2-(5-decoxy-6-formyl-2-pyridinyl)-1-hydroxyethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-(5-decoxy-6-formylpyridin-2-yl)-1-hydroxyethyl]benzoate Traditional Name: 3-[2-(5-decoxy-6-formyl-2-pyridyl)-1-hydroxy-ethyl]benzoic acid methyl ester Formula: C26H35NO5 MolecularWeight: 441.5598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(N=C(C=C1)CC(C2=CC=CC(=C2)C(=O)OC)O)C=O

Isomeric SMILES

CCCCCCCCCCOC1=C(N=C(C=C1)CC(C2=CC=CC(=C2)C(=O)OC)O)C=O

InChI

InChI=1S/C26H35NO5/c1-3-4-5-6-7-8-9-10-16-32-25-15-14-22(27-23(25)19-28)18-24(29)20-12-11-13-21(17-20)26(30)31-2/h11-15,17,19,24,29H,3-10,16,18H2,1-2H3