4-[(E)-3-(6-bromanyl-1,3-benzodioxol-5-yl)prop-2-enoyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 4-[(E)-3-(6-bromanyl-1,3-benzodioxol-5-yl)prop-2-enoyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 4-[(E)-3-(6-bromo-1,3-benzodioxol-5-yl)prop-2-enoyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 4-[(E)-3-(6-bromo-1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 4-[(E)-3-(6-bromo-1,3-benzodioxol-5-yl)prop-2-enoyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 4-[(E)-3-(6-bromo-1,3-benzodioxol-5-yl)acryloyl]-N,N-dimethyl-benzenesulfonamide Formula: C18H16BrNO5S MolecularWeight: 438.29234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)C=CC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)/C=C/C2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C18H16BrNO5S/c1-20(2)26(22,23)14-6-3-12(4-7-14)16(21)8-5-13-9-17-18(10-15(13)19)25-11-24-17/h3-10H,11H2,1-2H3/b8-5+