4-chloranyl-3-(2-chloroethyl)-2-methyl-1,10-phenanthrolin-10-ium chloride

Systemtic Name: 4-chloranyl-3-(2-chloroethyl)-2-methyl-1,10-phenanthrolin-10-ium chloride Openeye Name: 4-chloro-3-(2-chloroethyl)-2-methyl-1,10-phenanthrolin-10-ium chloride CAS Name: 4-chloro-3-(2-chloroethyl)-2-methyl-1,10-phenanthrolin-10-ium chloride IUPAC Name: 4-chloro-3-(2-chloroethyl)-2-methyl-1,10-phenanthrolin-10-ium chloride Traditional Name: 4-chloro-3-(2-chloroethyl)-2-methyl-1,10-phenanthrolin-10-ium chloride Formula: C15H13Cl3N2 MolecularWeight: 327.63612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC3=C2[NH+]=CC=C3)C(=C1CCCl)Cl.[Cl-]

Isomeric SMILES

CC1=NC2=C(C=CC3=C2[NH+]=CC=C3)C(=C1CCCl)Cl.[Cl-]

InChI

InChI=1S/C15H12Cl2N2.ClH/c1-9-11(6-7-16)13(17)12-5-4-10-3-2-8-18-14(10)15(12)19-9;/h2-5,8H,6-7H2,1H3;1H