(2-cyanophenyl)methylsulfonyl-[2-(dimethylazaniumyl)ethyl]azanide

Systemtic Name: (2-cyanophenyl)methylsulfonyl-[2-(dimethylazaniumyl)ethyl]azanide Openeye Name: (2-cyanophenyl)methylsulfonyl-[2-(dimethylammonio)ethyl]azanide CAS Name: (2-cyanophenyl)methylsulfonyl-[2-(dimethylammonio)ethyl]azanide IUPAC Name: (2-cyanophenyl)methylsulfonyl-[2-(dimethylazaniumyl)ethyl]azanide Traditional Name: (2-cyanobenzyl)sulfonyl-[2-(dimethylammonio)ethyl]azanide Formula: C12H17N3O2S MolecularWeight: 267.34728

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC[N-]S(=O)(=O)CC1=CC=CC=C1C#N

Isomeric SMILES

C[NH+](C)CC[N-]S(=O)(=O)CC1=CC=CC=C1C#N

InChI

InChI=1S/C12H16N3O2S/c1-15(2)8-7-14-18(16,17)10-12-6-4-3-5-11(12)9-13/h3-6H,7-8,10H2,1-2H3/q-1/p+1