N,N-diethyl-4-[methyl-[(2-methylphenyl)methyl]amino]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[methyl-[(2-methylphenyl)methyl]amino]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[methyl(o-tolylmethyl)amino]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[methyl-[(2-methylphenyl)methyl]amino]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[methyl-[(2-methylphenyl)methyl]amino]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-[methyl-(2-methylbenzyl)amino]-3-nitro-benzenesulfonamide Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N(C)CC2=CC=CC=C2C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N(C)CC2=CC=CC=C2C)[N+](=O)[O-]

InChI

InChI=1S/C19H25N3O4S/c1-5-21(6-2)27(25,26)17-11-12-18(19(13-17)22(23)24)20(4)14-16-10-8-7-9-15(16)3/h7-13H,5-6,14H2,1-4H3