N'-benzo[b][1,10]phenanthrolin-7-yl-N-(2-chloroethyl)propane-1,3-diamine dihydrochloride

Systemtic Name: N'-benzo[b][1,10]phenanthrolin-7-yl-N-(2-chloroethyl)propane-1,3-diamine dihydrochloride Openeye Name: N'-benzo[b][1,10]phenanthrolin-7-yl-N-(2-chloroethyl)propane-1,3-diamine dihydrochloride CAS Name: N'-(7-benzo[b][1,10]phenanthrolinyl)-N-(2-chloroethyl)propane-1,3-diamine dihydrochloride IUPAC Name: N'-benzo[b][1,10]phenanthrolin-7-yl-N-(2-chloroethyl)propane-1,3-diamine dihydrochloride Traditional Name: benzo[b][1,10]phenanthrolin-7-yl-[3-(2-chloroethylamino)propyl]amine dihydrochloride Formula: C21H23Cl3N4 MolecularWeight: 437.79312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC4=C(C3=N2)N=CC=C4)NCCCNCCCl.Cl.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC4=C(C3=N2)N=CC=C4)NCCCNCCCl.Cl.Cl

InChI

InChI=1S/C21H21ClN4.2ClH/c22-10-14-23-11-4-13-25-20-16-6-1-2-7-18(16)26-21-17(20)9-8-15-5-3-12-24-19(15)21;;/h1-3,5-9,12,23H,4,10-11,13-14H2,(H,25,26);2*1H