(E)-3-(3,5-dimethyl-4-oxidanyl-phenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(3,5-dimethyl-4-oxidanyl-phenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(4-hydroxy-3,5-dimethyl-phenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one CAS Name: (E)-3-(4-hydroxy-3,5-dimethylphenyl)-1-(4-methylsulfonylphenyl)-2-propen-1-one IUPAC Name: (E)-3-(4-hydroxy-3,5-dimethylphenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-hydroxy-3,5-dimethyl-phenyl)-1-(4-mesylphenyl)prop-2-en-1-one Formula: C18H18O4S MolecularWeight: 330.39812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C=CC(=O)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC(=C1O)C)/C=C/C(=O)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C18H18O4S/c1-12-10-14(11-13(2)18(12)20)4-9-17(19)15-5-7-16(8-6-15)23(3,21)22/h4-11,20H,1-3H3/b9-4+