N-but-3-enyl-N-(2,6-dimethylphenyl)-2-nitro-benzenesulfonamide

Systemtic Name: N-but-3-enyl-N-(2,6-dimethylphenyl)-2-nitro-benzenesulfonamide Openeye Name: N-but-3-enyl-N-(2,6-dimethylphenyl)-2-nitro-benzenesulfonamide CAS Name: N-but-3-enyl-N-(2,6-dimethylphenyl)-2-nitrobenzenesulfonamide IUPAC Name: N-but-3-enyl-N-(2,6-dimethylphenyl)-2-nitrobenzenesulfonamide Traditional Name: N-but-3-enyl-N-(2,6-dimethylphenyl)-2-nitro-benzenesulfonamide Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O4S/c1-4-5-13-19(18-14(2)9-8-10-15(18)3)25(23,24)17-12-7-6-11-16(17)20(21)22/h4,6-12H,1,5,13H2,2-3H3