2-[azanyl-(4-methylphenyl)methylidene]azaniumylethyl-dimethyl-azanium dichloride

Systemtic Name: 2-[azanyl-(4-methylphenyl)methylidene]azaniumylethyl-dimethyl-azanium dichloride Openeye Name: 2-[amino(p-tolyl)methylene]ammonioethyl-dimethyl-ammonium dichloride CAS Name: 2-[amino-(4-methylphenyl)methylidene]ammonioethyl-dimethylammonium dichloride IUPAC Name: 2-[amino-(4-methylphenyl)methylidene]azaniumylethyl-dimethylazanium dichloride Traditional Name: 2-[amino(p-tolyl)methylene]ammonioethyl-dimethyl-ammonium dichloride Formula: C12H21Cl2N3 MolecularWeight: 278.22124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=[NH+]CC[NH+](C)C)N.[Cl-].[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)/C(=[NH+]/CC[NH+](C)C)/N.[Cl-].[Cl-]

InChI

InChI=1S/C12H19N3.2ClH/c1-10-4-6-11(7-5-10)12(13)14-8-9-15(2)3;;/h4-7H,8-9H2,1-3H3,(H2,13,14);2*1H