1-(2-methyl-3-nitro-phenyl)sulfonylpiperazin-4-ium

Systemtic Name: 1-(2-methyl-3-nitro-phenyl)sulfonylpiperazin-4-ium Openeye Name: 1-(2-methyl-3-nitro-phenyl)sulfonylpiperazin-4-ium CAS Name: 1-(2-methyl-3-nitrophenyl)sulfonylpiperazin-4-ium IUPAC Name: 1-(2-methyl-3-nitrophenyl)sulfonylpiperazin-4-ium Traditional Name: 1-(2-methyl-3-nitro-phenyl)sulfonylpiperazin-4-ium Formula: C11H16N3O4S+ MolecularWeight: 286.32744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1S(=O)(=O)N2CC[NH2+]CC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1S(=O)(=O)N2CC[NH2+]CC2)[N+](=O)[O-]

InChI

InChI=1S/C11H15N3O4S/c1-9-10(14(15)16)3-2-4-11(9)19(17,18)13-7-5-12-6-8-13/h2-4,12H,5-8H2,1H3/p+1