(6-chloranyl-2-methoxy-acridin-9-yl)-[2-(2-chloroethylazaniumyl)ethyl]azanium dichloride

Systemtic Name: (6-chloranyl-2-methoxy-acridin-9-yl)-[2-(2-chloroethylazaniumyl)ethyl]azanium dichloride Openeye Name: 2-chloroethyl-[2-[(6-chloro-2-methoxy-acridin-9-yl)ammonio]ethyl]ammonium dichloride CAS Name: 2-chloroethyl-[2-[(6-chloro-2-methoxy-9-acridinyl)ammonio]ethyl]ammonium dichloride IUPAC Name: 2-chloroethyl-[2-[(6-chloro-2-methoxyacridin-9-yl)azaniumyl]ethyl]azanium dichloride Traditional Name: 2-chloroethyl-[2-[(6-chloro-2-methoxy-acridin-9-yl)ammonio]ethyl]ammonium dichloride Formula: C18H21Cl4N3O MolecularWeight: 437.19084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)[NH2+]CC[NH2+]CCCl.[Cl-].[Cl-]

Isomeric SMILES

COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)[NH2+]CC[NH2+]CCCl.[Cl-].[Cl-]

InChI

InChI=1S/C18H19Cl2N3O.2ClH/c1-24-13-3-5-16-15(11-13)18(22-9-8-21-7-6-19)14-4-2-12(20)10-17(14)23-16;;/h2-5,10-11,21H,6-9H2,1H3,(H,22,23);2*1H