methyl 2-(4-ethylphenyl)-2-oxidanyl-2-(6-oxidanylidenecyclohexen-1-yl)ethanoate

Systemtic Name: methyl 2-(4-ethylphenyl)-2-oxidanyl-2-(6-oxidanylidenecyclohexen-1-yl)ethanoate Openeye Name: methyl 2-(4-ethylphenyl)-2-hydroxy-2-(6-oxocyclohexen-1-yl)acetate CAS Name: 2-(4-ethylphenyl)-2-hydroxy-2-(6-oxo-1-cyclohexenyl)acetic acid methyl ester IUPAC Name: methyl 2-(4-ethylphenyl)-2-hydroxy-2-(6-oxocyclohexen-1-yl)acetate Traditional Name: 2-(4-ethylphenyl)-2-hydroxy-2-(6-ketocyclohexen-1-yl)acetic acid methyl ester Formula: C17H20O4 MolecularWeight: 288.3383

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CCCCC2=O)(C(=O)OC)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CCCCC2=O)(C(=O)OC)O

InChI

InChI=1S/C17H20O4/c1-3-12-8-10-13(11-9-12)17(20,16(19)21-2)14-6-4-5-7-15(14)18/h6,8-11,20H,3-5,7H2,1-2H3