tert-butyl (4R,5R)-4-(4-chlorophenyl)-2-oxidanylidene-5-phenoxycarbothioyloxy-piperidine-1-carboxylate

Systemtic Name: tert-butyl (4R,5R)-4-(4-chlorophenyl)-2-oxidanylidene-5-phenoxycarbothioyloxy-piperidine-1-carboxylate Openeye Name: tert-butyl (4R,5R)-4-(4-chlorophenyl)-2-oxo-5-phenoxycarbothioyloxy-piperidine-1-carboxylate CAS Name: (4R,5R)-4-(4-chlorophenyl)-2-oxo-5-[phenoxy(sulfanylidene)methoxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4R,5R)-4-(4-chlorophenyl)-2-oxo-5-phenoxycarbothioyloxypiperidine-1-carboxylate Traditional Name: (4R,5R)-4-(4-chlorophenyl)-2-keto-5-phenoxycarbothioyloxy-piperidine-1-carboxylic acid tert-butyl ester Formula: C23H24ClNO5S MolecularWeight: 461.95836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(C(CC1=O)C2=CC=C(C=C2)Cl)OC(=S)OC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@@H]([C@H](CC1=O)C2=CC=C(C=C2)Cl)OC(=S)OC3=CC=CC=C3

InChI

InChI=1S/C23H24ClNO5S/c1-23(2,3)30-21(27)25-14-19(29-22(31)28-17-7-5-4-6-8-17)18(13-20(25)26)15-9-11-16(24)12-10-15/h4-12,18-19H,13-14H2,1-3H3/t18-,19+/m1/s1