tert-butyl (2R,3S)-3-acetyloxy-2-phenyl-3-(2-phenylprop-2-enyl)piperidine-1-carboxylate

Systemtic Name: tert-butyl (2R,3S)-3-acetyloxy-2-phenyl-3-(2-phenylprop-2-enyl)piperidine-1-carboxylate Openeye Name: tert-butyl (2R,3S)-3-acetoxy-2-phenyl-3-(2-phenylallyl)piperidine-1-carboxylate CAS Name: (2R,3S)-3-acetyloxy-2-phenyl-3-(2-phenylprop-2-enyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,3S)-3-acetyloxy-2-phenyl-3-(2-phenylprop-2-enyl)piperidine-1-carboxylate Traditional Name: (2R,3S)-3-acetoxy-2-phenyl-3-(2-phenylallyl)piperidine-1-carboxylic acid tert-butyl ester Formula: C27H33NO4 MolecularWeight: 435.55522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(CCCN(C1C2=CC=CC=C2)C(=O)OC(C)(C)C)CC(=C)C3=CC=CC=C3

Isomeric SMILES

CC(=O)O[C@@]1(CCCN([C@@H]1C2=CC=CC=C2)C(=O)OC(C)(C)C)CC(=C)C3=CC=CC=C3

InChI

InChI=1S/C27H33NO4/c1-20(22-13-8-6-9-14-22)19-27(31-21(2)29)17-12-18-28(25(30)32-26(3,4)5)24(27)23-15-10-7-11-16-23/h6-11,13-16,24H,1,12,17-19H2,2-5H3/t24-,27+/m1/s1