methyl (4E)-4-butylidene-3-oxidanylidene-cyclohexene-1-carboxylate

Systemtic Name: methyl (4E)-4-butylidene-3-oxidanylidene-cyclohexene-1-carboxylate Openeye Name: methyl (4E)-4-butylidene-3-oxo-cyclohexene-1-carboxylate CAS Name: (4E)-4-butylidene-3-oxo-1-cyclohexenecarboxylic acid methyl ester IUPAC Name: methyl (4E)-4-butylidene-3-oxocyclohexene-1-carboxylate Traditional Name: (4E)-4-butylidene-3-keto-cyclohexene-1-carboxylic acid methyl ester Formula: C12H16O3 MolecularWeight: 208.25364

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=C1CCC(=CC1=O)C(=O)OC

Isomeric SMILES

CCC/C=C/1\CCC(=CC1=O)C(=O)OC

InChI

InChI=1S/C12H16O3/c1-3-4-5-9-6-7-10(8-11(9)13)12(14)15-2/h5,8H,3-4,6-7H2,1-2H3/b9-5+