[5-(azaniumylmethyl)-2-methyl-phenyl]sulfonyl-quinolin-8-yl-azanide

Systemtic Name: [5-(azaniumylmethyl)-2-methyl-phenyl]sulfonyl-quinolin-8-yl-azanide Openeye Name: [5-(azaniumylmethyl)-2-methyl-phenyl]sulfonyl-(8-quinolyl)azanide CAS Name: [5-(ammoniomethyl)-2-methylphenyl]sulfonyl-(8-quinolinyl)azanide IUPAC Name: [5-(azaniumylmethyl)-2-methylphenyl]sulfonyl-quinolin-8-ylazanide Traditional Name: [5-(ammoniomethyl)-2-methyl-phenyl]sulfonyl-(8-quinolyl)azanide Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C[NH3+])S(=O)(=O)[N-]C2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C[NH3+])S(=O)(=O)[N-]C2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C17H16N3O2S/c1-12-7-8-13(11-18)10-16(12)23(21,22)20-15-6-2-4-14-5-3-9-19-17(14)15/h2-10H,11,18H2,1H3/q-1/p+1