dimethyl (3R,5R,6R)-5-deuterio-3,6-diphenyl-2-(phenylmethyl)-1,2-oxazinane-4,4-dicarboxylate

Systemtic Name: dimethyl (3R,5R,6R)-5-deuterio-3,6-diphenyl-2-(phenylmethyl)-1,2-oxazinane-4,4-dicarboxylate Openeye Name: dimethyl (3R,5R,6R)-2-benzyl-5-deuterio-3,6-diphenyl-oxazinane-4,4-dicarboxylate CAS Name: (3R,5R,6R)-5-deuterio-3,6-diphenyl-2-(phenylmethyl)oxazinane-4,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (3R,5R,6R)-2-benzyl-5-deuterio-3,6-diphenyloxazinane-4,4-dicarboxylate Traditional Name: (3R,5R,6R)-2-benzyl-5-deuterio-3,6-diphenyl-oxazinane-4,4-dicarboxylic acid dimethyl ester Formula: C27H27NO5 MolecularWeight: 446.513142

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC(ON(C1C2=CC=CC=C2)CC3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

[H][C@@]1([C@@H](ON([C@@H](C1(C(=O)OC)C(=O)OC)C2=CC=CC=C2)CC3=CC=CC=C3)C4=CC=CC=C4)[2H]

InChI

InChI=1S/C27H27NO5/c1-31-25(29)27(26(30)32-2)18-23(21-14-8-4-9-15-21)33-28(19-20-12-6-3-7-13-20)24(27)22-16-10-5-11-17-22/h3-17,23-24H,18-19H2,1-2H3/t23-,24-/m1/s1/i18D/t18-,23+,24+/m0