1-(4-tert-butylphenyl)-4-[2-[(4-chlorophenyl)-pyridin-2-yl-methoxy]piperidin-1-yl]butan-1-one

Systemtic Name: 1-(4-tert-butylphenyl)-4-[2-[(4-chlorophenyl)-pyridin-2-yl-methoxy]piperidin-1-yl]butan-1-one Openeye Name: 1-(4-tert-butylphenyl)-4-[2-[(4-chlorophenyl)-(2-pyridyl)methoxy]-1-piperidyl]butan-1-one CAS Name: 1-(4-tert-butylphenyl)-4-[2-[(4-chlorophenyl)-(2-pyridinyl)methoxy]-1-piperidinyl]-1-butanone IUPAC Name: 1-(4-tert-butylphenyl)-4-[2-[(4-chlorophenyl)-pyridin-2-ylmethoxy]piperidin-1-yl]butan-1-one Traditional Name: 1-(4-tert-butylphenyl)-4-[2-[(4-chlorophenyl)-(2-pyridyl)methoxy]piperidino]butan-1-one Formula: C31H37ClN2O2 MolecularWeight: 505.09068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCCCC2OC(C3=CC=C(C=C3)Cl)C4=CC=CC=N4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCCCC2OC(C3=CC=C(C=C3)Cl)C4=CC=CC=N4

InChI

InChI=1S/C31H37ClN2O2/c1-31(2,3)25-16-12-23(13-17-25)28(35)10-8-22-34-21-7-5-11-29(34)36-30(27-9-4-6-20-33-27)24-14-18-26(32)19-15-24/h4,6,9,12-20,29-30H,5,7-8,10-11,21-22H2,1-3H3