N-[(4-dimethylaminophenyl)methyl]-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[4-(dimethylamino)benzyl]-4-methyl-3-nitro-benzenesulfonamide Formula: C16H19N3O4S MolecularWeight: 349.40476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O4S/c1-12-4-9-15(10-16(12)19(20)21)24(22,23)17-11-13-5-7-14(8-6-13)18(2)3/h4-10,17H,11H2,1-3H3