methyl 2-ethanoylhept-6-ynoate

Systemtic Name: methyl 2-ethanoylhept-6-ynoate Openeye Name: methyl 2-acetylhept-6-ynoate CAS Name: 2-acetyl-6-heptynoic acid methyl ester IUPAC Name: methyl 2-acetylhept-6-ynoate Traditional Name: 2-acetylhept-6-ynoic acid methyl ester Formula: C10H14O3 MolecularWeight: 182.21636

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCCC#C)C(=O)OC

Isomeric SMILES

CC(=O)C(CCCC#C)C(=O)OC

InChI

InChI=1S/C10H14O3/c1-4-5-6-7-9(8(2)11)10(12)13-3/h1,9H,5-7H2,2-3H3