(3-ethanoylphenyl)-[4-[(methylazaniumyl)methyl]phenyl]sulfonyl-azanide

Systemtic Name: (3-ethanoylphenyl)-[4-[(methylazaniumyl)methyl]phenyl]sulfonyl-azanide Openeye Name: (3-acetylphenyl)-[4-[(methylammonio)methyl]phenyl]sulfonyl-azanide CAS Name: (3-acetylphenyl)-[4-[(methylammonio)methyl]phenyl]sulfonylazanide IUPAC Name: (3-acetylphenyl)-[4-[(methylazaniumyl)methyl]phenyl]sulfonylazanide Traditional Name: (3-acetylphenyl)-[4-[(methylammonio)methyl]phenyl]sulfonyl-azanide Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)C[NH2+]C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)C[NH2+]C

InChI

InChI=1S/C16H17N2O3S/c1-12(19)14-4-3-5-15(10-14)18-22(20,21)16-8-6-13(7-9-16)11-17-2/h3-10,17H,11H2,1-2H3/q-1/p+1