1-(2,5-dimethylphenoxy)-3-[4-(phenylmethyl)piperazin-1-yl]propan-2-ol dichloride

Systemtic Name: 1-(2,5-dimethylphenoxy)-3-[4-(phenylmethyl)piperazin-1-yl]propan-2-ol dichloride Openeye Name: 1-(4-benzylpiperazin-1-yl)-3-(2,5-dimethylphenoxy)propan-2-ol dichloride CAS Name: 1-(2,5-dimethylphenoxy)-3-[4-(phenylmethyl)-1-piperazinyl]-2-propanol dichloride IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-(2,5-dimethylphenoxy)propan-2-ol dichloride Traditional Name: 1-(4-benzylpiperazino)-3-(2,5-dimethylphenoxy)propan-2-ol dichloride Formula: C22H30Cl2N2O2-2 MolecularWeight: 425.3918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(CN2CCN(CC2)CC3=CC=CC=C3)O.[Cl-].[Cl-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC(CN2CCN(CC2)CC3=CC=CC=C3)O.[Cl-].[Cl-]

InChI

InChI=1S/C22H30N2O2.2ClH/c1-18-8-9-19(2)22(14-18)26-17-21(25)16-24-12-10-23(11-13-24)15-20-6-4-3-5-7-20;;/h3-9,14,21,25H,10-13,15-17H2,1-2H3;2*1H/p-2