1-[2,5-bis[3-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]ethanone tetrahydrochloride

Systemtic Name: 1-[2,5-bis[3-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]ethanone tetrahydrochloride Openeye Name: 1-[2,5-bis[3-[4-(3-chlorophenyl)piperazin-1-yl]-2-hydroxy-propoxy]phenyl]ethanone tetrahydrochloride CAS Name: 1-[2,5-bis[3-[4-(3-chlorophenyl)-1-piperazinyl]-2-hydroxypropoxy]phenyl]ethanone tetrahydrochloride IUPAC Name: 1-[2,5-bis[3-[4-(3-chlorophenyl)piperazin-1-yl]-2-hydroxypropoxy]phenyl]ethanone tetrahydrochloride Traditional Name: 1-[2,5-bis[3-[4-(3-chlorophenyl)piperazino]-2-hydroxy-propoxy]phenyl]ethanone tetrahydrochloride Formula: C34H46Cl6N4O5 MolecularWeight: 803.47084

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1)OCC(CN2CCN(CC2)C3=CC(=CC=C3)Cl)O)OCC(CN4CCN(CC4)C5=CC(=CC=C5)Cl)O.Cl.Cl.Cl.Cl

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1)OCC(CN2CCN(CC2)C3=CC(=CC=C3)Cl)O)OCC(CN4CCN(CC4)C5=CC(=CC=C5)Cl)O.Cl.Cl.Cl.Cl

InChI

InChI=1S/C34H42Cl2N4O5.4ClH/c1-25(41)33-20-32(44-23-30(42)21-37-10-14-39(15-11-37)28-6-2-4-26(35)18-28)8-9-34(33)45-24-31(43)22-38-12-16-40(17-13-38)29-7-3-5-27(36)19-29;;;;/h2-9,18-20,30-31,42-43H,10-17,21-24H2,1H3;4*1H