dimethyl-[4-(1-methyl-9H-pyrido[3,4-b]indol-9-ium-4-yl)butyl]azanium dichloride

Systemtic Name: dimethyl-[4-(1-methyl-9H-pyrido[3,4-b]indol-9-ium-4-yl)butyl]azanium dichloride Openeye Name: dimethyl-[4-(1-methyl-9H-pyrido[3,4-b]indol-9-ium-4-yl)butyl]ammonium dichloride CAS Name: dimethyl-[4-(1-methyl-9H-pyrido[3,4-b]indol-9-ium-4-yl)butyl]ammonium dichloride IUPAC Name: dimethyl-[4-(1-methyl-9H-pyrido[3,4-b]indol-9-ium-4-yl)butyl]azanium dichloride Traditional Name: dimethyl-[4-(1-methyl-9H-$b-carbolin-9-ium-4-yl)butyl]ammonium dichloride Formula: C18H25Cl2N3 MolecularWeight: 354.3172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C2=C1[NH2+]C3=CC=CC=C32)CCCC[NH+](C)C.[Cl-].[Cl-]

Isomeric SMILES

CC1=NC=C(C2=C1[NH2+]C3=CC=CC=C32)CCCC[NH+](C)C.[Cl-].[Cl-]

InChI

InChI=1S/C18H23N3.2ClH/c1-13-18-17(15-9-4-5-10-16(15)20-18)14(12-19-13)8-6-7-11-21(2)3;;/h4-5,9-10,12,20H,6-8,11H2,1-3H3;2*1H