N-[(E)-4-(4-methoxyphenyl)but-3-enyl]-N-methyl-4-nitro-benzenesulfonamide

Systemtic Name: N-[(E)-4-(4-methoxyphenyl)but-3-enyl]-N-methyl-4-nitro-benzenesulfonamide Openeye Name: N-[(E)-4-(4-methoxyphenyl)but-3-enyl]-N-methyl-4-nitro-benzenesulfonamide CAS Name: N-[(E)-4-(4-methoxyphenyl)but-3-enyl]-N-methyl-4-nitrobenzenesulfonamide IUPAC Name: N-[(E)-4-(4-methoxyphenyl)but-3-enyl]-N-methyl-4-nitrobenzenesulfonamide Traditional Name: N-[(E)-4-(4-methoxyphenyl)but-3-enyl]-N-methyl-4-nitro-benzenesulfonamide Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC=CC1=CC=C(C=C1)OC)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(CC/C=C/C1=CC=C(C=C1)OC)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O5S/c1-19(14-4-3-5-15-6-10-17(25-2)11-7-15)26(23,24)18-12-8-16(9-13-18)20(21)22/h3,5-13H,4,14H2,1-2H3/b5-3+