(E)-3-(4-methoxy-3-propoxy-phenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(4-methoxy-3-propoxy-phenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(4-methoxy-3-propoxy-phenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one CAS Name: (E)-3-(4-methoxy-3-propoxyphenyl)-1-(4-methylsulfonylphenyl)-2-propen-1-one IUPAC Name: (E)-3-(4-methoxy-3-propoxyphenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-mesylphenyl)-3-(4-methoxy-3-propoxy-phenyl)prop-2-en-1-one Formula: C20H22O5S MolecularWeight: 374.45068

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)C=CC(=O)C2=CC=C(C=C2)S(=O)(=O)C)OC

Isomeric SMILES

CCCOC1=C(C=CC(=C1)/C=C/C(=O)C2=CC=C(C=C2)S(=O)(=O)C)OC

InChI

InChI=1S/C20H22O5S/c1-4-13-25-20-14-15(6-12-19(20)24-2)5-11-18(21)16-7-9-17(10-8-16)26(3,22)23/h5-12,14H,4,13H2,1-3H3/b11-5+