methyl 4-cyano-5,5-dimethyl-hept-6-ynoate

Systemtic Name: methyl 4-cyano-5,5-dimethyl-hept-6-ynoate Openeye Name: methyl 4-cyano-5,5-dimethyl-hept-6-ynoate CAS Name: 4-cyano-5,5-dimethyl-6-heptynoic acid methyl ester IUPAC Name: methyl 4-cyano-5,5-dimethylhept-6-ynoate Traditional Name: 4-cyano-5,5-dimethyl-hept-6-ynoic acid methyl ester Formula: C11H15NO2 MolecularWeight: 193.2423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15NO2/c1-5-11(2,3)9(8-12)6-7-10(13)14-4/h1,9H,6-7H2,2-4H3