tert-butyl 4-[4-(3-chloranyl-4-fluoranyl-phenyl)-3-methyl-phenyl]-4-oxidanyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(3-chloranyl-4-fluoranyl-phenyl)-3-methyl-phenyl]-4-oxidanyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(3-chloro-4-fluoro-phenyl)-3-methyl-phenyl]-4-hydroxy-piperidine-1-carboxylate CAS Name: 4-[4-(3-chloro-4-fluorophenyl)-3-methylphenyl]-4-hydroxy-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(3-chloro-4-fluorophenyl)-3-methylphenyl]-4-hydroxypiperidine-1-carboxylate Traditional Name: 4-[4-(3-chloro-4-fluoro-phenyl)-3-methyl-phenyl]-4-hydroxy-piperidine-1-carboxylic acid tert-butyl ester Formula: C23H27ClFNO3 MolecularWeight: 419.916783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2(CCN(CC2)C(=O)OC(C)(C)C)O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C2(CCN(CC2)C(=O)OC(C)(C)C)O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C23H27ClFNO3/c1-15-13-17(6-7-18(15)16-5-8-20(25)19(24)14-16)23(28)9-11-26(12-10-23)21(27)29-22(2,3)4/h5-8,13-14,28H,9-12H2,1-4H3