methyl 3-[(E)-but-2-enyl]-2-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: methyl 3-[(E)-but-2-enyl]-2-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: methyl 3-[(E)-but-2-enyl]-2-oxo-cyclohexanecarboxylate CAS Name: 3-[(E)-but-2-enyl]-2-oxo-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 3-[(E)-but-2-enyl]-2-oxocyclohexane-1-carboxylate Traditional Name: 3-[(E)-but-2-enyl]-2-keto-cyclohexanecarboxylic acid methyl ester Formula: C12H18O3 MolecularWeight: 210.26952

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCC1CCCC(C1=O)C(=O)OC

Isomeric SMILES

C/C=C/CC1CCCC(C1=O)C(=O)OC

InChI

InChI=1S/C12H18O3/c1-3-4-6-9-7-5-8-10(11(9)13)12(14)15-2/h3-4,9-10H,5-8H2,1-2H3/b4-3+