4-[3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[3-(3-bromo-4-hydroxy-5-methoxy-phenyl)prop-2-enoyl]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[3-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-oxoprop-2-enyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[3-(3-bromo-4-hydroxy-5-methoxyphenyl)prop-2-enoyl]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[3-(3-bromo-4-hydroxy-5-methoxy-phenyl)acryloyl]-N,N-diethyl-benzenesulfonamide Formula: C20H22BrNO5S MolecularWeight: 468.36138

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)C=CC2=CC(=C(C(=C2)Br)O)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)C=CC2=CC(=C(C(=C2)Br)O)OC

InChI

InChI=1S/C20H22BrNO5S/c1-4-22(5-2)28(25,26)16-9-7-15(8-10-16)18(23)11-6-14-12-17(21)20(24)19(13-14)27-3/h6-13,24H,4-5H2,1-3H3