methyl 8-(6-methylpyridin-2-yl)-7-oxidanylidene-oct-2-ynoate

Systemtic Name: methyl 8-(6-methylpyridin-2-yl)-7-oxidanylidene-oct-2-ynoate Openeye Name: methyl 8-(6-methyl-2-pyridyl)-7-oxo-oct-2-ynoate CAS Name: 8-(6-methyl-2-pyridinyl)-7-oxo-2-octynoic acid methyl ester IUPAC Name: methyl 8-(6-methylpyridin-2-yl)-7-oxooct-2-ynoate Traditional Name: 7-keto-8-(6-methyl-2-pyridyl)oct-2-ynoic acid methyl ester Formula: C15H17NO3 MolecularWeight: 259.30038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CC(=O)CCCC#CC(=O)OC

Isomeric SMILES

CC1=NC(=CC=C1)CC(=O)CCCC#CC(=O)OC

InChI

InChI=1S/C15H17NO3/c1-12-7-6-8-13(16-12)11-14(17)9-4-3-5-10-15(18)19-2/h6-8H,3-4,9,11H2,1-2H3