N-(2-dimethylaminoethyl)-4-[methyl-(phenylmethyl)amino]-3-nitro-benzenesulfonamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-[methyl-(phenylmethyl)amino]-3-nitro-benzenesulfonamide Openeye Name: 4-[benzyl(methyl)amino]-N-(2-dimethylaminoethyl)-3-nitro-benzenesulfonamide CAS Name: N-(2-dimethylaminoethyl)-4-[methyl-(phenylmethyl)amino]-3-nitrobenzenesulfonamide IUPAC Name: 4-[benzyl(methyl)amino]-N-(2-dimethylaminoethyl)-3-nitrobenzenesulfonamide Traditional Name: 4-[benzyl(methyl)amino]-N-(2-dimethylaminoethyl)-3-nitro-benzenesulfonamide Formula: C18H24N4O4S MolecularWeight: 392.47256

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNS(=O)(=O)C1=CC(=C(C=C1)N(C)CC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCNS(=O)(=O)C1=CC(=C(C=C1)N(C)CC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H24N4O4S/c1-20(2)12-11-19-27(25,26)16-9-10-17(18(13-16)22(23)24)21(3)14-15-7-5-4-6-8-15/h4-10,13,19H,11-12,14H2,1-3H3