tert-butyl (2S,3R)-3-[2,6-bis[(1R)-1-ethoxyethyl]phenyl]selanyl-2-phenyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl (2S,3R)-3-[2,6-bis[(1R)-1-ethoxyethyl]phenyl]selanyl-2-phenyl-piperidine-1-carboxylate Openeye Name: tert-butyl (2S,3R)-3-[2,6-bis[(1R)-1-ethoxyethyl]phenyl]selanyl-2-phenyl-piperidine-1-carboxylate CAS Name: (2S,3R)-3-[[2,6-bis[(1R)-1-ethoxyethyl]phenyl]seleno]-2-phenyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3R)-3-[2,6-bis[(1R)-1-ethoxyethyl]phenyl]selanyl-2-phenylpiperidine-1-carboxylate Traditional Name: (2S,3R)-3-[[2,6-bis[(1R)-1-ethoxyethyl]phenyl]seleno]-2-phenyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C30H43NO4Se MolecularWeight: 560.62672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)C1=C(C(=CC=C1)C(C)OCC)[Se]C2CCCN(C2C3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CCO[C@H](C)C1=C(C(=CC=C1)[C@@H](C)OCC)[Se][C@@H]2CCCN([C@H]2C3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C30H43NO4Se/c1-8-33-21(3)24-17-13-18-25(22(4)34-9-2)28(24)36-26-19-14-20-31(29(32)35-30(5,6)7)27(26)23-15-11-10-12-16-23/h10-13,15-18,21-22,26-27H,8-9,14,19-20H2,1-7H3/t21-,22-,26-,27+/m1/s1