1-(2-tert-butylquinolin-4-yl)-3-(1-phenethylpiperidin-4-yl)propan-1-one

Systemtic Name: 1-(2-tert-butylquinolin-4-yl)-3-(1-phenethylpiperidin-4-yl)propan-1-one Openeye Name: 1-(2-tert-butyl-4-quinolyl)-3-(1-phenethyl-4-piperidyl)propan-1-one CAS Name: 1-(2-tert-butyl-4-quinolinyl)-3-(1-phenethyl-4-piperidinyl)-1-propanone IUPAC Name: 1-(2-tert-butylquinolin-4-yl)-3-(1-phenethylpiperidin-4-yl)propan-1-one Traditional Name: 1-(2-tert-butyl-4-quinolyl)-3-(1-phenethyl-4-piperidyl)propan-1-one Formula: C29H36N2O MolecularWeight: 428.60894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=CC=CC=C2C(=C1)C(=O)CCC3CCN(CC3)CCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NC2=CC=CC=C2C(=C1)C(=O)CCC3CCN(CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C29H36N2O/c1-29(2,3)28-21-25(24-11-7-8-12-26(24)30-28)27(32)14-13-23-16-19-31(20-17-23)18-15-22-9-5-4-6-10-22/h4-12,21,23H,13-20H2,1-3H3