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

Systemtic Name: 1-(4-tert-butylphenyl)-4-[4-[(4-chlorophenyl)-pyridin-2-yl-methoxy]piperidin-1-yl]butan-1-one Openeye Name: 1-(4-tert-butylphenyl)-4-[4-[(4-chlorophenyl)-(2-pyridyl)methoxy]-1-piperidyl]butan-1-one CAS Name: 1-(4-tert-butylphenyl)-4-[4-[(4-chlorophenyl)-(2-pyridinyl)methoxy]-1-piperidinyl]-1-butanone IUPAC Name: 1-(4-tert-butylphenyl)-4-[4-[(4-chlorophenyl)-pyridin-2-ylmethoxy]piperidin-1-yl]butan-1-one Traditional Name: 1-(4-tert-butylphenyl)-4-[4-[(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)CCCN2CCC(CC2)OC(C3=CC=C(C=C3)Cl)C4=CC=CC=N4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCC(CC2)OC(C3=CC=C(C=C3)Cl)C4=CC=CC=N4

InChI

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