(2S)-2-(2-chloranyl-5-methyl-phenoxy)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: (2S)-2-(2-chloranyl-5-methyl-phenoxy)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: (2S)-2-(2-chloro-5-methyl-phenoxy)-1-[4-(2-pyridyl)piperazin-1-yl]propan-1-one CAS Name: (2S)-2-(2-chloro-5-methylphenoxy)-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: (2S)-2-(2-chloro-5-methylphenoxy)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: (2S)-2-(2-chloro-5-methyl-phenoxy)-1-[4-(2-pyridyl)piperazino]propan-1-one Formula: C19H22ClN3O2 MolecularWeight: 359.84988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OC(C)C(=O)N2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)O[C@@H](C)C(=O)N2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C19H22ClN3O2/c1-14-6-7-16(20)17(13-14)25-15(2)19(24)23-11-9-22(10-12-23)18-5-3-4-8-21-18/h3-8,13,15H,9-12H2,1-2H3/t15-/m0/s1