4-[[(2,6-dimethyl-3-nitro-pyridin-4-yl)amino]methyl]benzenesulfonamide hydrochloride

Systemtic Name: 4-[[(2,6-dimethyl-3-nitro-pyridin-4-yl)amino]methyl]benzenesulfonamide hydrochloride Openeye Name: 4-[[(2,6-dimethyl-3-nitro-4-pyridyl)amino]methyl]benzenesulfonamide hydrochloride CAS Name: 4-[[(2,6-dimethyl-3-nitro-4-pyridinyl)amino]methyl]benzenesulfonamide hydrochloride IUPAC Name: 4-[[(2,6-dimethyl-3-nitropyridin-4-yl)amino]methyl]benzenesulfonamide hydrochloride Traditional Name: 4-[[(2,6-dimethyl-3-nitro-4-pyridyl)amino]methyl]benzenesulfonamide hydrochloride Formula: C14H17ClN4O4S MolecularWeight: 372.82718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N4O4S.ClH/c1-9-7-13(14(18(19)20)10(2)17-9)16-8-11-3-5-12(6-4-11)23(15,21)22;/h3-7H,8H2,1-2H3,(H,16,17)(H2,15,21,22);1H