2-chloranyl-N1-methyl-N1-(1-methylpiperidin-1-ium-4-yl)benzene-1,4-diamine

Systemtic Name: 2-chloranyl-N1-methyl-N1-(1-methylpiperidin-1-ium-4-yl)benzene-1,4-diamine Openeye Name: 2-chloro-N1-methyl-N1-(1-methylpiperidin-1-ium-4-yl)benzene-1,4-diamine CAS Name: 2-chloro-N1-methyl-N1-(1-methyl-4-piperidin-1-iumyl)benzene-1,4-diamine IUPAC Name: 2-chloro-1-N-methyl-1-N-(1-methylpiperidin-1-ium-4-yl)benzene-1,4-diamine Traditional Name: (4-amino-2-chloro-phenyl)-methyl-(1-methylpiperidin-1-ium-4-yl)amine Formula: C13H21ClN3+ MolecularWeight: 254.77894

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)C2=C(C=C(C=C2)N)Cl

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C2=C(C=C(C=C2)N)Cl

InChI

InChI=1S/C13H20ClN3/c1-16-7-5-11(6-8-16)17(2)13-4-3-10(15)9-12(13)14/h3-4,9,11H,5-8,15H2,1-2H3/p+1