4-chloranyl-N1-(2-pyridin-1-ium-1-ylethyl)benzene-1,2-diamine chloride

Systemtic Name: 4-chloranyl-N1-(2-pyridin-1-ium-1-ylethyl)benzene-1,2-diamine chloride Openeye Name: 4-chloro-N1-(2-pyridin-1-ium-1-ylethyl)benzene-1,2-diamine chloride CAS Name: 4-chloro-N1-[2-(1-pyridin-1-iumyl)ethyl]benzene-1,2-diamine chloride IUPAC Name: 4-chloro-1-N-(2-pyridin-1-ium-1-ylethyl)benzene-1,2-diamine chloride Traditional Name: (2-amino-4-chloro-phenyl)-(2-pyridin-1-ium-1-ylethyl)amine chloride Formula: C13H15Cl2N3 MolecularWeight: 284.1843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CCNC2=C(C=C(C=C2)Cl)N.[Cl-]

Isomeric SMILES

C1=CC=[N+](C=C1)CCNC2=C(C=C(C=C2)Cl)N.[Cl-]

InChI

InChI=1S/C13H15ClN3.ClH/c14-11-4-5-13(12(15)10-11)16-6-9-17-7-2-1-3-8-17;/h1-5,7-8,10,16H,6,9,15H2;1H/q+1;/p-1