N-tert-butyl-4-[(4-methylphenyl)methylamino]-3-nitro-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-[(4-methylphenyl)methylamino]-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-3-nitro-4-(p-tolylmethylamino)benzenesulfonamide CAS Name: N-tert-butyl-4-[(4-methylphenyl)methylamino]-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-[(4-methylphenyl)methylamino]-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-[(4-methylbenzyl)amino]-3-nitro-benzenesulfonamide Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=C(C=C(C=C2)S(=O)(=O)NC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=C(C=C(C=C2)S(=O)(=O)NC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O4S/c1-13-5-7-14(8-6-13)12-19-16-10-9-15(11-17(16)21(22)23)26(24,25)20-18(2,3)4/h5-11,19-20H,12H2,1-4H3