1-[4-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propoxy]naphthalen-1-yl]propan-1-one dihydrochloride

Systemtic Name: 1-[4-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propoxy]naphthalen-1-yl]propan-1-one dihydrochloride Openeye Name: 1-[4-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]-1-naphthyl]propan-1-one dihydrochloride CAS Name: 1-[4-[2-hydroxy-3-(4-phenyl-1-piperazinyl)propoxy]-1-naphthalenyl]-1-propanone dihydrochloride IUPAC Name: 1-[4-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]naphthalen-1-yl]propan-1-one dihydrochloride Traditional Name: 1-[4-[2-hydroxy-3-(4-phenylpiperazino)propoxy]-1-naphthyl]propan-1-one dihydrochloride Formula: C26H32Cl2N2O3 MolecularWeight: 491.44988

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C2=CC=CC=C21)OCC(CN3CCN(CC3)C4=CC=CC=C4)O.Cl.Cl

Isomeric SMILES

CCC(=O)C1=CC=C(C2=CC=CC=C21)OCC(CN3CCN(CC3)C4=CC=CC=C4)O.Cl.Cl

InChI

InChI=1S/C26H30N2O3.2ClH/c1-2-25(30)23-12-13-26(24-11-7-6-10-22(23)24)31-19-21(29)18-27-14-16-28(17-15-27)20-8-4-3-5-9-20;;/h3-13,21,29H,2,14-19H2,1H3;2*1H