2-[3-(4-chlorophenyl)sulfanylpropylazaniumyl]ethyl-dimethyl-azanium

Systemtic Name: 2-[3-(4-chlorophenyl)sulfanylpropylazaniumyl]ethyl-dimethyl-azanium Openeye Name: 2-[3-(4-chlorophenyl)sulfanylpropylammonio]ethyl-dimethyl-ammonium CAS Name: 2-[3-[(4-chlorophenyl)thio]propylammonio]ethyl-dimethylammonium IUPAC Name: 2-[3-(4-chlorophenyl)sulfanylpropylazaniumyl]ethyl-dimethylazanium Traditional Name: 2-[3-[(4-chlorophenyl)thio]propylammonio]ethyl-dimethyl-ammonium Formula: C13H23ClN2S+2 MolecularWeight: 274.85312

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC[NH2+]CCCSC1=CC=C(C=C1)Cl

Isomeric SMILES

C[NH+](C)CC[NH2+]CCCSC1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H21ClN2S/c1-16(2)10-9-15-8-3-11-17-13-6-4-12(14)5-7-13/h4-7,15H,3,8-11H2,1-2H3/p+2