(phenylmethyl) (5S,6R)-6-methyl-5-oxidanyl-4-oxidanylidene-3-[(1R)-1-phenylethyl]-1,3-diazinane-1-carboxylate

Systemtic Name: (phenylmethyl) (5S,6R)-6-methyl-5-oxidanyl-4-oxidanylidene-3-[(1R)-1-phenylethyl]-1,3-diazinane-1-carboxylate Openeye Name: benzyl (5S,6R)-5-hydroxy-6-methyl-4-oxo-3-[(1R)-1-phenylethyl]hexahydropyrimidine-1-carboxylate CAS Name: (5S,6R)-5-hydroxy-6-methyl-4-oxo-3-[(1R)-1-phenylethyl]-1,3-diazinane-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (5S,6R)-5-hydroxy-6-methyl-4-oxo-3-[(1R)-1-phenylethyl]-1,3-diazinane-1-carboxylate Traditional Name: (5S,6R)-5-hydroxy-4-keto-6-methyl-3-[(1R)-1-phenylethyl]hexahydropyrimidine-1-carboxylic acid benzyl ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)N(CN1C(=O)OCC2=CC=CC=C2)C(C)C3=CC=CC=C3)O

Isomeric SMILES

C[C@@H]1[C@@H](C(=O)N(CN1C(=O)OCC2=CC=CC=C2)[C@H](C)C3=CC=CC=C3)O

InChI

InChI=1S/C21H24N2O4/c1-15(18-11-7-4-8-12-18)22-14-23(16(2)19(24)20(22)25)21(26)27-13-17-9-5-3-6-10-17/h3-12,15-16,19,24H,13-14H2,1-2H3/t15-,16-,19+/m1/s1