methyl 8-oxidanyl-8-(2-pentoxypyridin-3-yl)oct-5-ynoate

Systemtic Name: methyl 8-oxidanyl-8-(2-pentoxypyridin-3-yl)oct-5-ynoate Openeye Name: methyl 8-hydroxy-8-(2-pentoxy-3-pyridyl)oct-5-ynoate CAS Name: 8-hydroxy-8-(2-pentoxy-3-pyridinyl)-5-octynoic acid methyl ester IUPAC Name: methyl 8-hydroxy-8-(2-pentoxypyridin-3-yl)oct-5-ynoate Traditional Name: 8-(2-amoxy-3-pyridyl)-8-hydroxy-oct-5-ynoic acid methyl ester Formula: C19H27NO4 MolecularWeight: 333.42198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC=N1)C(CC#CCCCC(=O)OC)O

Isomeric SMILES

CCCCCOC1=C(C=CC=N1)C(CC#CCCCC(=O)OC)O

InChI

InChI=1S/C19H27NO4/c1-3-4-9-15-24-19-16(11-10-14-20-19)17(21)12-7-5-6-8-13-18(22)23-2/h10-11,14,17,21H,3-4,6,8-9,12-13,15H2,1-2H3