(E)-3-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-2-(4-fluorophenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-2-(4-fluorophenyl)sulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(3-bromo-4-ethoxy-5-methoxy-phenyl)-2-(4-fluorophenyl)sulfonyl-prop-2-enenitrile CAS Name: (E)-3-(3-bromo-4-ethoxy-5-methoxyphenyl)-2-(4-fluorophenyl)sulfonyl-2-propenenitrile IUPAC Name: (E)-3-(3-bromo-4-ethoxy-5-methoxyphenyl)-2-(4-fluorophenyl)sulfonylprop-2-enenitrile Traditional Name: (E)-3-(3-bromo-4-ethoxy-5-methoxy-phenyl)-2-(4-fluorophenyl)sulfonyl-acrylonitrile Formula: C18H15BrFNO4S MolecularWeight: 440.283403

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)F)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)/C=C(\C#N)/S(=O)(=O)C2=CC=C(C=C2)F)OC

InChI

InChI=1S/C18H15BrFNO4S/c1-3-25-18-16(19)9-12(10-17(18)24-2)8-15(11-21)26(22,23)14-6-4-13(20)5-7-14/h4-10H,3H2,1-2H3/b15-8+