(2S)-2-(4-chloranyl-3,5-dimethyl-phenoxy)-1-(4-oxidanylpiperidin-1-yl)propan-1-one

Systemtic Name: (2S)-2-(4-chloranyl-3,5-dimethyl-phenoxy)-1-(4-oxidanylpiperidin-1-yl)propan-1-one Openeye Name: (2S)-2-(4-chloro-3,5-dimethyl-phenoxy)-1-(4-hydroxy-1-piperidyl)propan-1-one CAS Name: (2S)-2-(4-chloro-3,5-dimethylphenoxy)-1-(4-hydroxy-1-piperidinyl)-1-propanone IUPAC Name: (2S)-2-(4-chloro-3,5-dimethylphenoxy)-1-(4-hydroxypiperidin-1-yl)propan-1-one Traditional Name: (2S)-2-(4-chloro-3,5-dimethyl-phenoxy)-1-(4-hydroxypiperidino)propan-1-one Formula: C16H22ClNO3 MolecularWeight: 311.80378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC(C)C(=O)N2CCC(CC2)O

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)O[C@@H](C)C(=O)N2CCC(CC2)O

InChI

InChI=1S/C16H22ClNO3/c1-10-8-14(9-11(2)15(10)17)21-12(3)16(20)18-6-4-13(19)5-7-18/h8-9,12-13,19H,4-7H2,1-3H3/t12-/m0/s1