2-[3-[bis(azanyl)methylideneamino]-5-ethyl-6-phenyl-phenanthridin-5-ium-8-yl]guanidine trihydrochloride

Systemtic Name: 2-[3-[bis(azanyl)methylideneamino]-5-ethyl-6-phenyl-phenanthridin-5-ium-8-yl]guanidine trihydrochloride Openeye Name: 2-(5-ethyl-3-guanidino-6-phenyl-phenanthridin-5-ium-8-yl)guanidine trihydrochloride CAS Name: 2-[3-(diaminomethylideneamino)-5-ethyl-6-phenyl-8-phenanthridin-5-iumyl]guanidine trihydrochloride IUPAC Name: 2-[3-(diaminomethylideneamino)-5-ethyl-6-phenylphenanthridin-5-ium-8-yl]guanidine trihydrochloride Traditional Name: 2-(5-ethyl-3-guanidino-6-phenyl-phenanthridin-5-ium-8-yl)guanidine trihydrochloride Formula: C23H27Cl3N7+ MolecularWeight: 507.86638

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N=C(N)N)N=C(N)N.Cl.Cl.Cl

Isomeric SMILES

CC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N=C(N)N)N=C(N)N.Cl.Cl.Cl

InChI

InChI=1S/C23H23N7.3ClH/c1-2-30-20-13-16(29-23(26)27)9-11-18(20)17-10-8-15(28-22(24)25)12-19(17)21(30)14-6-4-3-5-7-14;;;/h3-13H,2H2,1H3,(H7,24,25,26,27,28);3*1H/p+1