1-[4-[4-[3-(3-methylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[3-(3-methylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[2-hydroxy-3-(3-methylphenoxy)propyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[2-hydroxy-3-(3-methylphenoxy)propyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[2-hydroxy-3-(3-methylphenoxy)propyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[2-hydroxy-3-(3-methylphenoxy)propyl]piperazino]phenyl]ethanone Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O3/c1-17-4-3-5-22(14-17)27-16-21(26)15-23-10-12-24(13-11-23)20-8-6-19(7-9-20)18(2)25/h3-9,14,21,26H,10-13,15-16H2,1-2H3