tert-butyl (3S,5S,6R)-3-(5-chloranylpentyl)-2-oxidanylidene-5,6-diphenyl-morpholine-4-carboxylate

Systemtic Name: tert-butyl (3S,5S,6R)-3-(5-chloranylpentyl)-2-oxidanylidene-5,6-diphenyl-morpholine-4-carboxylate Openeye Name: tert-butyl (3S,5S,6R)-3-(5-chloropentyl)-2-oxo-5,6-diphenyl-morpholine-4-carboxylate CAS Name: (3S,5S,6R)-3-(5-chloropentyl)-2-oxo-5,6-diphenyl-4-morpholinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S,5S,6R)-3-(5-chloropentyl)-2-oxo-5,6-diphenylmorpholine-4-carboxylate Traditional Name: (3S,5S,6R)-3-(5-chloropentyl)-2-keto-5,6-diphenyl-morpholine-4-carboxylic acid tert-butyl ester Formula: C26H32ClNO4 MolecularWeight: 457.98958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@H](C(=O)O[C@@H]([C@@H]1C2=CC=CC=C2)C3=CC=CC=C3)CCCCCCl

InChI

InChI=1S/C26H32ClNO4/c1-26(2,3)32-25(30)28-21(17-11-6-12-18-27)24(29)31-23(20-15-9-5-10-16-20)22(28)19-13-7-4-8-14-19/h4-5,7-10,13-16,21-23H,6,11-12,17-18H2,1-3H3/t21-,22-,23+/m0/s1