1-[4-[(3S)-3-(4-chloranyl-2-methyl-phenyl)carbonylpiperidin-1-yl]carbonylpiperidin-1-yl]ethanone

Systemtic Name: 1-[4-[(3S)-3-(4-chloranyl-2-methyl-phenyl)carbonylpiperidin-1-yl]carbonylpiperidin-1-yl]ethanone Openeye Name: 1-[4-[(3S)-3-(4-chloro-2-methyl-benzoyl)piperidine-1-carbonyl]-1-piperidyl]ethanone CAS Name: 1-[4-[[(3S)-3-[(4-chloro-2-methylphenyl)-oxomethyl]-1-piperidinyl]-oxomethyl]-1-piperidinyl]ethanone IUPAC Name: 1-[4-[(3S)-3-(4-chloro-2-methylbenzoyl)piperidine-1-carbonyl]piperidin-1-yl]ethanone Traditional Name: 1-[4-[(3S)-3-(4-chloro-2-methyl-benzoyl)piperidine-1-carbonyl]piperidino]ethanone Formula: C21H27ClN2O3 MolecularWeight: 390.90368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)C(=O)C2CCCN(C2)C(=O)C3CCN(CC3)C(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)C(=O)[C@H]2CCCN(C2)C(=O)C3CCN(CC3)C(=O)C

InChI

InChI=1S/C21H27ClN2O3/c1-14-12-18(22)5-6-19(14)20(26)17-4-3-9-24(13-17)21(27)16-7-10-23(11-8-16)15(2)25/h5-6,12,16-17H,3-4,7-11,13H2,1-2H3/t17-/m0/s1