(E)-6,6-dimethyl-5-(phenylsulfonyl)hept-3-en-2-one

Systemtic Name: (E)-6,6-dimethyl-5-(phenylsulfonyl)hept-3-en-2-one Openeye Name: (E)-5-(benzenesulfonyl)-6,6-dimethyl-hept-3-en-2-one CAS Name: (E)-5-(benzenesulfonyl)-6,6-dimethyl-3-hepten-2-one IUPAC Name: (E)-5-(benzenesulfonyl)-6,6-dimethylhept-3-en-2-one Traditional Name: (E)-5-besyl-6,6-dimethyl-hept-3-en-2-one Formula: C15H20O3S MolecularWeight: 280.3825

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC(C(C)(C)C)S(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CC(=O)/C=C/C(C(C)(C)C)S(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C15H20O3S/c1-12(16)10-11-14(15(2,3)4)19(17,18)13-8-6-5-7-9-13/h5-11,14H,1-4H3/b11-10+