(4,6,6-trimethyl-2-oxidanylidene-cyclohex-3-en-1-yl) 2-chloranylpropanoate

Systemtic Name: (4,6,6-trimethyl-2-oxidanylidene-cyclohex-3-en-1-yl) 2-chloranylpropanoate Openeye Name: (4,6,6-trimethyl-2-oxo-cyclohex-3-en-1-yl) 2-chloropropanoate CAS Name: 2-chloropropanoic acid (4,6,6-trimethyl-2-oxo-1-cyclohex-3-enyl) ester IUPAC Name: (4,6,6-trimethyl-2-oxocyclohex-3-en-1-yl) 2-chloropropanoate Traditional Name: 2-chloropropionic acid (2-keto-4,6,6-trimethyl-cyclohex-3-en-1-yl) ester Formula: C12H17ClO3 MolecularWeight: 244.71458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(C(C1)(C)C)OC(=O)C(C)Cl

Isomeric SMILES

CC1=CC(=O)C(C(C1)(C)C)OC(=O)C(C)Cl

InChI

InChI=1S/C12H17ClO3/c1-7-5-9(14)10(12(3,4)6-7)16-11(15)8(2)13/h5,8,10H,6H2,1-4H3