2-azaniumylethylsulfonyl-(3-chloranyl-4-methyl-phenyl)azanide

Systemtic Name: 2-azaniumylethylsulfonyl-(3-chloranyl-4-methyl-phenyl)azanide Openeye Name: 2-azaniumylethylsulfonyl-(3-chloro-4-methyl-phenyl)azanide CAS Name: 2-ammonioethylsulfonyl-(3-chloro-4-methylphenyl)azanide IUPAC Name: 2-azaniumylethylsulfonyl-(3-chloro-4-methylphenyl)azanide Traditional Name: 2-ammonioethylsulfonyl-(3-chloro-4-methyl-phenyl)azanide Formula: C9H13ClN2O2S MolecularWeight: 248.72972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N-]S(=O)(=O)CC[NH3+])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)[N-]S(=O)(=O)CC[NH3+])Cl

InChI

InChI=1S/C9H12ClN2O2S/c1-7-2-3-8(6-9(7)10)12-15(13,14)5-4-11/h2-3,6H,4-5,11H2,1H3/q-1/p+1