4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]-3-methyl-phenol dihydrochloride

Systemtic Name: 4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]-3-methyl-phenol dihydrochloride Openeye Name: 4-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]-3-methyl-phenol dihydrochloride CAS Name: 4-[2-hydroxy-3-[4-(2-methoxyphenyl)-1-piperazinyl]propoxy]-3-methylphenol dihydrochloride IUPAC Name: 4-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]-3-methylphenol dihydrochloride Traditional Name: 4-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazino]propoxy]-3-methyl-phenol dihydrochloride Formula: C21H30Cl2N2O4 MolecularWeight: 445.3799

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)O)OCC(CN2CCN(CC2)C3=CC=CC=C3OC)O.Cl.Cl

Isomeric SMILES

CC1=C(C=CC(=C1)O)OCC(CN2CCN(CC2)C3=CC=CC=C3OC)O.Cl.Cl

InChI

InChI=1S/C21H28N2O4.2ClH/c1-16-13-17(24)7-8-20(16)27-15-18(25)14-22-9-11-23(12-10-22)19-5-3-4-6-21(19)26-2;;/h3-8,13,18,24-25H,9-12,14-15H2,1-2H3;2*1H