(3-cyanophenyl)-[4-[(ethylazaniumyl)methyl]phenyl]sulfonyl-azanide

Systemtic Name: (3-cyanophenyl)-[4-[(ethylazaniumyl)methyl]phenyl]sulfonyl-azanide Openeye Name: (3-cyanophenyl)-[4-[(ethylammonio)methyl]phenyl]sulfonyl-azanide CAS Name: (3-cyanophenyl)-[4-[(ethylammonio)methyl]phenyl]sulfonylazanide IUPAC Name: (3-cyanophenyl)-[4-[(ethylazaniumyl)methyl]phenyl]sulfonylazanide Traditional Name: (3-cyanophenyl)-[4-[(ethylammonio)methyl]phenyl]sulfonyl-azanide Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CC1=CC=C(C=C1)S(=O)(=O)[N-]C2=CC=CC(=C2)C#N

Isomeric SMILES

CC[NH2+]CC1=CC=C(C=C1)S(=O)(=O)[N-]C2=CC=CC(=C2)C#N

InChI

InChI=1S/C16H16N3O2S/c1-2-18-12-13-6-8-16(9-7-13)22(20,21)19-15-5-3-4-14(10-15)11-17/h3-10,18H,2,12H2,1H3/q-1/p+1