tert-butyl (2S,4R)-4-(4-bromophenyl)-2-oxidanyl-6-phenyl-3,4-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: tert-butyl (2S,4R)-4-(4-bromophenyl)-2-oxidanyl-6-phenyl-3,4-dihydro-2H-pyridine-1-carboxylate Openeye Name: tert-butyl (2S,4R)-4-(4-bromophenyl)-2-hydroxy-6-phenyl-3,4-dihydro-2H-pyridine-1-carboxylate CAS Name: (2S,4R)-4-(4-bromophenyl)-2-hydroxy-6-phenyl-3,4-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,4R)-4-(4-bromophenyl)-2-hydroxy-6-phenyl-3,4-dihydro-2H-pyridine-1-carboxylate Traditional Name: (2S,4R)-4-(4-bromophenyl)-2-hydroxy-6-phenyl-3,4-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester Formula: C22H24BrNO3 MolecularWeight: 430.33486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CC(C=C1C2=CC=CC=C2)C3=CC=C(C=C3)Br)O

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@H](C[C@H](C=C1C2=CC=CC=C2)C3=CC=C(C=C3)Br)O

InChI

InChI=1S/C22H24BrNO3/c1-22(2,3)27-21(26)24-19(16-7-5-4-6-8-16)13-17(14-20(24)25)15-9-11-18(23)12-10-15/h4-13,17,20,25H,14H2,1-3H3/t17-,20-/m0/s1