2-tert-butyl-4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenol hydrochloride

Systemtic Name: 2-tert-butyl-4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenol hydrochloride Openeye Name: 2-tert-butyl-4-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenol hydrochloride CAS Name: 2-tert-butyl-4-[2-hydroxy-3-[4-(2-methoxyphenyl)-1-piperazinyl]propoxy]phenol hydrochloride IUPAC Name: 2-tert-butyl-4-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenol hydrochloride Traditional Name: 2-tert-butyl-4-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazino]propoxy]phenol hydrochloride Formula: C24H35ClN2O4 MolecularWeight: 450.9987

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H34N2O4.ClH/c1-24(2,3)20-15-19(9-10-22(20)28)30-17-18(27)16-25-11-13-26(14-12-25)21-7-5-6-8-23(21)29-4;/h5-10,15,18,27-28H,11-14,16-17H2,1-4H3;1H