methyl (Z)-2-ethyl-6,6-dimethyl-hept-2-en-4-ynoate

Systemtic Name: methyl (Z)-2-ethyl-6,6-dimethyl-hept-2-en-4-ynoate Openeye Name: methyl (Z)-2-ethyl-6,6-dimethyl-hept-2-en-4-ynoate CAS Name: (Z)-2-ethyl-6,6-dimethylhept-2-en-4-ynoic acid methyl ester IUPAC Name: methyl (Z)-2-ethyl-6,6-dimethylhept-2-en-4-ynoate Traditional Name: (Z)-2-ethyl-6,6-dimethyl-hept-2-en-4-ynoic acid methyl ester Formula: C12H18O2 MolecularWeight: 194.27012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18O2/c1-6-10(11(13)14-5)8-7-9-12(2,3)4/h8H,6H2,1-5H3/b10-8-