3-azanylpropyl-[4-(4-butoxyphenyl)butan-2-yl]-dimethyl-azanium dihydrochloride

Systemtic Name: 3-azanylpropyl-[4-(4-butoxyphenyl)butan-2-yl]-dimethyl-azanium dihydrochloride Openeye Name: 3-aminopropyl-[3-(4-butoxyphenyl)-1-methyl-propyl]-dimethyl-ammonium dihydrochloride CAS Name: 3-aminopropyl-[4-(4-butoxyphenyl)butan-2-yl]-dimethylammonium dihydrochloride IUPAC Name: 3-aminopropyl-[4-(4-butoxyphenyl)butan-2-yl]-dimethylazanium dihydrochloride Traditional Name: 3-aminopropyl-[3-(4-butoxyphenyl)-1-methyl-propyl]-dimethyl-ammonium dihydrochloride Formula: C19H37Cl2N2O+ MolecularWeight: 380.41588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CCC(C)[N+](C)(C)CCCN.Cl.Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CCC(C)[N+](C)(C)CCCN.Cl.Cl

InChI

InChI=1S/C19H35N2O.2ClH/c1-5-6-16-22-19-12-10-18(11-13-19)9-8-17(2)21(3,4)15-7-14-20;;/h10-13,17H,5-9,14-16,20H2,1-4H3;2*1H/q+1;;