methyl (4S,5S,6R)-1-ethyl-6-methyl-2-oxidanylidene-4-phenethyl-1,3-diazinane-5-carboxylate

Systemtic Name: methyl (4S,5S,6R)-1-ethyl-6-methyl-2-oxidanylidene-4-phenethyl-1,3-diazinane-5-carboxylate Openeye Name: methyl (4S,5S,6R)-1-ethyl-6-methyl-2-oxo-4-phenethyl-hexahydropyrimidine-5-carboxylate CAS Name: (4S,5S,6R)-1-ethyl-6-methyl-2-oxo-4-phenethyl-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl (4S,5S,6R)-1-ethyl-6-methyl-2-oxo-4-phenethyl-1,3-diazinane-5-carboxylate Traditional Name: (4S,5S,6R)-1-ethyl-2-keto-6-methyl-4-phenethyl-hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C17H24N2O3 MolecularWeight: 304.38406

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(C(C(NC1=O)CCC2=CC=CC=C2)C(=O)OC)C

Isomeric SMILES

CCN1[C@@H]([C@H]([C@@H](NC1=O)CCC2=CC=CC=C2)C(=O)OC)C

InChI

InChI=1S/C17H24N2O3/c1-4-19-12(2)15(16(20)22-3)14(18-17(19)21)11-10-13-8-6-5-7-9-13/h5-9,12,14-15H,4,10-11H2,1-3H3,(H,18,21)/t12-,14+,15-/m1/s1