4-[(6-chloranyl-2-methoxy-acridin-9-yl)azaniumyl]pentyl-diethyl-azanium dichloride

Systemtic Name: 4-[(6-chloranyl-2-methoxy-acridin-9-yl)azaniumyl]pentyl-diethyl-azanium dichloride Openeye Name: 4-[(6-chloro-2-methoxy-acridin-9-yl)ammonio]pentyl-diethyl-ammonium dichloride CAS Name: 4-[(6-chloro-2-methoxy-9-acridinyl)ammonio]pentyl-diethylammonium dichloride IUPAC Name: 4-[(6-chloro-2-methoxyacridin-9-yl)azaniumyl]pentyl-diethylazanium dichloride Traditional Name: 4-[(6-chloro-2-methoxy-acridin-9-yl)ammonio]pentyl-diethyl-ammonium dichloride Formula: C23H32Cl3N3O MolecularWeight: 472.87868

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)[NH2+]C1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC.[Cl-].[Cl-]

Isomeric SMILES

CC[NH+](CC)CCCC(C)[NH2+]C1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC.[Cl-].[Cl-]

InChI

InChI=1S/C23H30ClN3O.2ClH/c1-5-27(6-2)13-7-8-16(3)25-23-19-11-9-17(24)14-22(19)26-21-12-10-18(28-4)15-20(21)23;;/h9-12,14-16H,5-8,13H2,1-4H3,(H,25,26);2*1H