[2-(azaniumylmethyl)phenyl]methylsulfonyl-[2-(diethylazaniumyl)ethyl]azanide

Systemtic Name: [2-(azaniumylmethyl)phenyl]methylsulfonyl-[2-(diethylazaniumyl)ethyl]azanide Openeye Name: [2-(azaniumylmethyl)phenyl]methylsulfonyl-[2-(diethylammonio)ethyl]azanide CAS Name: [2-(ammoniomethyl)phenyl]methylsulfonyl-[2-(diethylammonio)ethyl]azanide IUPAC Name: [2-(azaniumylmethyl)phenyl]methylsulfonyl-[2-(diethylazaniumyl)ethyl]azanide Traditional Name: [2-(ammoniomethyl)benzyl]sulfonyl-[2-(diethylammonio)ethyl]azanide Formula: C14H26N3O2S+ MolecularWeight: 300.44014

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC[N-]S(=O)(=O)CC1=CC=CC=C1C[NH3+]

Isomeric SMILES

CC[NH+](CC)CC[N-]S(=O)(=O)CC1=CC=CC=C1C[NH3+]

InChI

InChI=1S/C14H24N3O2S/c1-3-17(4-2)10-9-16-20(18,19)12-14-8-6-5-7-13(14)11-15/h5-8H,3-4,9-12,15H2,1-2H3/q-1/p+2