(4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl)methyl (E)-but-2-enoate

Systemtic Name: (4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl)methyl (E)-but-2-enoate Openeye Name: (4,4-dimethyl-6-oxo-cyclohexen-1-yl)methyl (E)-but-2-enoate CAS Name: (E)-2-butenoic acid (4,4-dimethyl-6-oxo-1-cyclohexenyl)methyl ester IUPAC Name: (4,4-dimethyl-6-oxocyclohexen-1-yl)methyl (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid (6-keto-4,4-dimethyl-cyclohexen-1-yl)methyl ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)OCC1=CCC(CC1=O)(C)C

Isomeric SMILES

C/C=C/C(=O)OCC1=CCC(CC1=O)(C)C

InChI

InChI=1S/C13H18O3/c1-4-5-12(15)16-9-10-6-7-13(2,3)8-11(10)14/h4-6H,7-9H2,1-3H3/b5-4+