[2,3-dimethyl-4-[4-(3-methylbut-2-en-2-yl)phenyl]-4-oxidanylidene-butan-2-yl] methanesulfonate

Systemtic Name: [2,3-dimethyl-4-[4-(3-methylbut-2-en-2-yl)phenyl]-4-oxidanylidene-butan-2-yl] methanesulfonate Openeye Name: [3-[4-(1,2-dimethylprop-1-enyl)phenyl]-1,1,2-trimethyl-3-oxo-propyl] methanesulfonate CAS Name: methanesulfonic acid [2,3-dimethyl-4-[4-(3-methylbut-2-en-2-yl)phenyl]-4-oxobutan-2-yl] ester IUPAC Name: [2,3-dimethyl-4-[4-(3-methylbut-2-en-2-yl)phenyl]-4-oxobutan-2-yl] methanesulfonate Traditional Name: methanesulfonic acid [3-[4-(1,2-dimethylprop-1-enyl)phenyl]-3-keto-1,1,2-trimethyl-propyl] ester Formula: C18H26O4S MolecularWeight: 338.46164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)C(=C(C)C)C)C(C)(C)OS(=O)(=O)C

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)C(=C(C)C)C)C(C)(C)OS(=O)(=O)C

InChI

InChI=1S/C18H26O4S/c1-12(2)13(3)15-8-10-16(11-9-15)17(19)14(4)18(5,6)22-23(7,20)21/h8-11,14H,1-7H3