1-[4-[(2R)-3-[4-(3-methylphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]ethanone

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CC(COC3=CC=C(C=C3)C(=O)C)O

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C[C@H](COC3=CC=C(C=C3)C(=O)C)O

InChI

InChI=1S/C22H28N2O3/c1-17-4-3-5-20(14-17)24-12-10-23(11-13-24)15-21(26)16-27-22-8-6-19(7-9-22)18(2)25/h3-9,14,21,26H,10-13,15-16H2,1-2H3/t21-/m1/s1