methyl 2-propanoylhept-5-ynoate

Systemtic Name: methyl 2-propanoylhept-5-ynoate Openeye Name: methyl 2-propanoylhept-5-ynoate CAS Name: 2-(1-oxopropyl)-5-heptynoic acid methyl ester IUPAC Name: methyl 2-propanoylhept-5-ynoate Traditional Name: 2-propionylhept-5-ynoic acid methyl ester Formula: C11H16O3 MolecularWeight: 196.24294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16O3/c1-4-6-7-8-9(10(12)5-2)11(13)14-3/h9H,5,7-8H2,1-3H3