4-methyl-N-(3-methyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-methyl-N-(3-methyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-3-nitro-benzenesulfonamide Openeye Name: 4-methyl-N-(3-methyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-3-nitro-benzenesulfonamide CAS Name: 4-methyl-N-(3-methyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-3-nitrobenzenesulfonamide IUPAC Name: 4-methyl-N-(3-methyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-3-nitrobenzenesulfonamide Traditional Name: 4-methyl-N-(3-methyl-1,2,3,4-tetrahydro-s-triazin-3-ium-6-yl)-3-nitro-benzenesulfonamide Formula: C11H16N5O4S+ MolecularWeight: 314.34084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=NC[NH+](CN2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=NC[NH+](CN2)C)[N+](=O)[O-]

InChI

InChI=1S/C11H15N5O4S/c1-8-3-4-9(5-10(8)16(17)18)21(19,20)14-11-12-6-15(2)7-13-11/h3-5H,6-7H2,1-2H3,(H2,12,13,14)/p+1