1-[4-[2-oxidanyl-4-(4-phenylpiperazin-1-yl)butoxy]phenyl]ethanone dihydrochloride

Systemtic Name: 1-[4-[2-oxidanyl-4-(4-phenylpiperazin-1-yl)butoxy]phenyl]ethanone dihydrochloride Openeye Name: 1-[4-[2-hydroxy-4-(4-phenylpiperazin-1-yl)butoxy]phenyl]ethanone dihydrochloride CAS Name: 1-[4-[2-hydroxy-4-(4-phenyl-1-piperazinyl)butoxy]phenyl]ethanone dihydrochloride IUPAC Name: 1-[4-[2-hydroxy-4-(4-phenylpiperazin-1-yl)butoxy]phenyl]ethanone dihydrochloride Traditional Name: 1-[4-[2-hydroxy-4-(4-phenylpiperazino)butoxy]phenyl]ethanone dihydrochloride Formula: C22H30Cl2N2O3 MolecularWeight: 441.3912

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCC(CCN2CCN(CC2)C3=CC=CC=C3)O.Cl.Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCC(CCN2CCN(CC2)C3=CC=CC=C3)O.Cl.Cl

InChI

InChI=1S/C22H28N2O3.2ClH/c1-18(25)19-7-9-22(10-8-19)27-17-21(26)11-12-23-13-15-24(16-14-23)20-5-3-2-4-6-20;;/h2-10,21,26H,11-17H2,1H3;2*1H