(E)-N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide

Systemtic Name: (E)-N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: (E)-N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-N-[5-(dimethylsulfamoyl)-2-methylphenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: (E)-N-[5-(dimethylsulfamoyl)-2-methylphenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C19H19N3O7S MolecularWeight: 433.43506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)C=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)/C=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C19H19N3O7S/c1-12-4-6-14(30(26,27)21(2)3)9-15(12)20-19(23)7-5-13-8-17-18(29-11-28-17)10-16(13)22(24)25/h4-10H,11H2,1-3H3,(H,20,23)/b7-5+