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

Systemtic Name: (E)-3-(5-bromanyl-2-methoxy-phenyl)-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(5-bromo-2-methoxy-phenyl)-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: (E)-3-(5-bromo-2-methoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: (E)-3-(5-bromo-2-methoxy-phenyl)-2-tosyl-acrylonitrile Formula: C17H14BrNO3S MolecularWeight: 392.26696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=C(C=CC(=C2)Br)OC)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/C2=C(C=CC(=C2)Br)OC)/C#N

InChI

InChI=1S/C17H14BrNO3S/c1-12-3-6-15(7-4-12)23(20,21)16(11-19)10-13-9-14(18)5-8-17(13)22-2/h3-10H,1-2H3/b16-10+