(E)-3-[3,4-bis(oxidanyl)phenyl]-N-[4-(2-dimethylaminoethylsulfamoyl)phenyl]-N-methyl-prop-2-enamide hydrochloride

Systemtic Name: (E)-3-[3,4-bis(oxidanyl)phenyl]-N-[4-(2-dimethylaminoethylsulfamoyl)phenyl]-N-methyl-prop-2-enamide hydrochloride Openeye Name: (E)-3-(3,4-dihydroxyphenyl)-N-[4-(2-dimethylaminoethylsulfamoyl)phenyl]-N-methyl-prop-2-enamide hydrochloride CAS Name: (E)-3-(3,4-dihydroxyphenyl)-N-[4-(2-dimethylaminoethylsulfamoyl)phenyl]-N-methyl-2-propenamide hydrochloride IUPAC Name: (E)-3-(3,4-dihydroxyphenyl)-N-[4-(2-dimethylaminoethylsulfamoyl)phenyl]-N-methylprop-2-enamide hydrochloride Traditional Name: (E)-3-(3,4-dihydroxyphenyl)-N-[4-(2-dimethylaminoethylsulfamoyl)phenyl]-N-methyl-acrylamide hydrochloride Formula: C20H26ClN3O5S MolecularWeight: 455.95554

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNS(=O)(=O)C1=CC=C(C=C1)N(C)C(=O)C=CC2=CC(=C(C=C2)O)O.Cl

Isomeric SMILES

CN(C)CCNS(=O)(=O)C1=CC=C(C=C1)N(C)C(=O)/C=C/C2=CC(=C(C=C2)O)O.Cl

InChI

InChI=1S/C20H25N3O5S.ClH/c1-22(2)13-12-21-29(27,28)17-8-6-16(7-9-17)23(3)20(26)11-5-15-4-10-18(24)19(25)14-15;/h4-11,14,21,24-25H,12-13H2,1-3H3;1H/b11-5+;