(E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one CAS Name: (E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-1-(4-methylsulfonylphenyl)-2-propen-1-one IUPAC Name: (E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-1-(4-methylsulfonylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)-1-(4-mesylphenyl)prop-2-en-1-one Formula: C20H21ClO5S MolecularWeight: 408.89574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Cl)C=CC(=O)C2=CC=C(C=C2)S(=O)(=O)C)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Cl)/C=C/C(=O)C2=CC=C(C=C2)S(=O)(=O)C)OC

InChI

InChI=1S/C20H21ClO5S/c1-13(2)26-20-17(21)11-14(12-19(20)25-3)5-10-18(22)15-6-8-16(9-7-15)27(4,23)24/h5-13H,1-4H3/b10-5+