6-bromanyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]quinolin-2-amine trihydrochloride

Systemtic Name: 6-bromanyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]quinolin-2-amine trihydrochloride Openeye Name: 6-bromo-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]quinolin-2-amine trihydrochloride CAS Name: 6-bromo-N-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-2-quinolinamine trihydrochloride IUPAC Name: 6-bromo-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]quinolin-2-amine trihydrochloride Traditional Name: (6-bromo-2-quinolyl)-[2-[4-(2-methoxyphenyl)piperazino]ethyl]amine trihydrochloride Formula: C22H28BrCl3N4O MolecularWeight: 550.74692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCNC3=NC4=C(C=C3)C=C(C=C4)Br.Cl.Cl.Cl

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCNC3=NC4=C(C=C3)C=C(C=C4)Br.Cl.Cl.Cl

InChI

InChI=1S/C22H25BrN4O.3ClH/c1-28-21-5-3-2-4-20(21)27-14-12-26(13-15-27)11-10-24-22-9-6-17-16-18(23)7-8-19(17)25-22;;;/h2-9,16H,10-15H2,1H3,(H,24,25);3*1H