3-chloranyl-N9-[5-(diethylamino)pentan-2-yl]-7-methoxy-acridine-2,9-diamine dihydrate dihydrochloride

Systemtic Name: 3-chloranyl-N9-[5-(diethylamino)pentan-2-yl]-7-methoxy-acridine-2,9-diamine dihydrate dihydrochloride Openeye Name: 3-chloro-N9-[4-(diethylamino)-1-methyl-butyl]-7-methoxy-acridine-2,9-diamine dihydrate dihydrochloride CAS Name: 3-chloro-N9-[5-(diethylamino)pentan-2-yl]-7-methoxyacridine-2,9-diamine dihydrate dihydrochloride IUPAC Name: 3-chloro-9-N-[5-(diethylamino)pentan-2-yl]-7-methoxyacridine-2,9-diamine dihydrate dihydrochloride Traditional Name: 4-[(2-amino-3-chloro-7-methoxy-acridin-9-yl)amino]pentyl-diethyl-amine dihydrate dihydrochloride Formula: C23H37Cl3N4O3 MolecularWeight: 523.92388

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC1=C2C=C(C=CC2=NC3=CC(=C(C=C31)N)Cl)OC.O.O.Cl.Cl

Isomeric SMILES

CCN(CC)CCCC(C)NC1=C2C=C(C=CC2=NC3=CC(=C(C=C31)N)Cl)OC.O.O.Cl.Cl

InChI

InChI=1S/C23H31ClN4O.2ClH.2H2O/c1-5-28(6-2)11-7-8-15(3)26-23-17-12-16(29-4)9-10-21(17)27-22-14-19(24)20(25)13-18(22)23;;;;/h9-10,12-15H,5-8,11,25H2,1-4H3,(H,26,27);2*1H;2*1H2