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

Systemtic Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-(3,5-dimethylphenoxy)propan-2-ol Openeye Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-(3,5-dimethylphenoxy)propan-2-ol CAS Name: 1-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-3-(3,5-dimethylphenoxy)-2-propanol IUPAC Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-(3,5-dimethylphenoxy)propan-2-ol Traditional Name: 1-[4-(4-chlorobenzyl)piperazino]-3-(3,5-dimethylphenoxy)propan-2-ol Formula: C22H29ClN2O2 MolecularWeight: 388.93086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(CN2CCN(CC2)CC3=CC=C(C=C3)Cl)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(CN2CCN(CC2)CC3=CC=C(C=C3)Cl)O)C

InChI

InChI=1S/C22H29ClN2O2/c1-17-11-18(2)13-22(12-17)27-16-21(26)15-25-9-7-24(8-10-25)14-19-3-5-20(23)6-4-19/h3-6,11-13,21,26H,7-10,14-16H2,1-2H3