methyl 2-methyl-2-[4-(3-oxidanylidenebutyl)cyclohexa-2,5-dien-1-yl]propanoate

Systemtic Name: methyl 2-methyl-2-[4-(3-oxidanylidenebutyl)cyclohexa-2,5-dien-1-yl]propanoate Openeye Name: methyl 2-methyl-2-[4-(3-oxobutyl)cyclohexa-2,5-dien-1-yl]propanoate CAS Name: 2-methyl-2-[4-(3-oxobutyl)-1-cyclohexa-2,5-dienyl]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[4-(3-oxobutyl)cyclohexa-2,5-dien-1-yl]propanoate Traditional Name: 2-[4-(3-ketobutyl)cyclohexa-2,5-dien-1-yl]-2-methyl-propionic acid methyl ester Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1C=CC(C=C1)C(C)(C)C(=O)OC

Isomeric SMILES

CC(=O)CCC1C=CC(C=C1)C(C)(C)C(=O)OC

InChI

InChI=1S/C15H22O3/c1-11(16)5-6-12-7-9-13(10-8-12)15(2,3)14(17)18-4/h7-10,12-13H,5-6H2,1-4H3