(E)-2-(4-bromophenyl)sulfonyl-3-(8-methoxy-2-methyl-2H-chromen-3-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-bromophenyl)sulfonyl-3-(8-methoxy-2-methyl-2H-chromen-3-yl)prop-2-enenitrile Openeye Name: (E)-2-(4-bromophenyl)sulfonyl-3-(8-methoxy-2-methyl-2H-chromen-3-yl)prop-2-enenitrile CAS Name: (E)-2-(4-bromophenyl)sulfonyl-3-(8-methoxy-2-methyl-2H-1-benzopyran-3-yl)-2-propenenitrile IUPAC Name: (E)-2-(4-bromophenyl)sulfonyl-3-(8-methoxy-2-methyl-2H-chromen-3-yl)prop-2-enenitrile Traditional Name: (E)-2-brosyl-3-(8-methoxy-2-methyl-2H-chromen-3-yl)acrylonitrile Formula: C20H16BrNO4S MolecularWeight: 446.31434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=CC2=C(O1)C(=CC=C2)OC)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1C(=CC2=C(O1)C(=CC=C2)OC)/C=C(\C#N)/S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H16BrNO4S/c1-13-15(10-14-4-3-5-19(25-2)20(14)26-13)11-18(12-22)27(23,24)17-8-6-16(21)7-9-17/h3-11,13H,1-2H3/b18-11+