[5-(azaniumylmethyl)-2-methyl-phenyl]sulfonyl-(4-dimethylaminophenyl)azanide

Systemtic Name: [5-(azaniumylmethyl)-2-methyl-phenyl]sulfonyl-(4-dimethylaminophenyl)azanide Openeye Name: [5-(azaniumylmethyl)-2-methyl-phenyl]sulfonyl-(4-dimethylaminophenyl)azanide CAS Name: [5-(ammoniomethyl)-2-methylphenyl]sulfonyl-(4-dimethylaminophenyl)azanide IUPAC Name: [5-(azaniumylmethyl)-2-methylphenyl]sulfonyl-(4-dimethylaminophenyl)azanide Traditional Name: [5-(ammoniomethyl)-2-methyl-phenyl]sulfonyl-(4-dimethylaminophenyl)azanide Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C[NH3+])S(=O)(=O)[N-]C2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C[NH3+])S(=O)(=O)[N-]C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C16H20N3O2S/c1-12-4-5-13(11-17)10-16(12)22(20,21)18-14-6-8-15(9-7-14)19(2)3/h4-10H,11,17H2,1-3H3/q-1/p+1