(E)-2-[(4-bromophenyl)methylsulfonyl]-3-(2,4,6-trimethoxyphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-[(4-bromophenyl)methylsulfonyl]-3-(2,4,6-trimethoxyphenyl)prop-2-enenitrile Openeye Name: (E)-2-[(4-bromophenyl)methylsulfonyl]-3-(2,4,6-trimethoxyphenyl)prop-2-enenitrile CAS Name: (E)-2-[(4-bromophenyl)methylsulfonyl]-3-(2,4,6-trimethoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-[(4-bromophenyl)methylsulfonyl]-3-(2,4,6-trimethoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(4-bromobenzyl)sulfonyl-3-(2,4,6-trimethoxyphenyl)acrylonitrile Formula: C19H18BrNO5S MolecularWeight: 452.31892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)OC)C=C(C#N)S(=O)(=O)CC2=CC=C(C=C2)Br)OC

Isomeric SMILES

COC1=CC(=C(C(=C1)OC)/C=C(\C#N)/S(=O)(=O)CC2=CC=C(C=C2)Br)OC

InChI

InChI=1S/C19H18BrNO5S/c1-24-15-8-18(25-2)17(19(9-15)26-3)10-16(11-21)27(22,23)12-13-4-6-14(20)7-5-13/h4-10H,12H2,1-3H3/b16-10+