2-methoxyethyl (5S,6R)-4-methylidene-2-oxidanylidene-6-(4-phenylmethoxyphenyl)-1,3-diazinane-5-carboxylate

Systemtic Name: 2-methoxyethyl (5S,6R)-4-methylidene-2-oxidanylidene-6-(4-phenylmethoxyphenyl)-1,3-diazinane-5-carboxylate Openeye Name: 2-methoxyethyl (4R,5S)-4-(4-benzyloxyphenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (5S,6R)-4-methylene-2-oxo-6-(4-phenylmethoxyphenyl)-1,3-diazinane-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (5S,6R)-4-methylidene-2-oxo-6-(4-phenylmethoxyphenyl)-1,3-diazinane-5-carboxylate Traditional Name: (4R,5S)-4-(4-benzoxyphenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C1C(NC(=O)NC1=C)C2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

COCCOC(=O)[C@H]1[C@@H](NC(=O)NC1=C)C2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O5/c1-15-19(21(25)28-13-12-27-2)20(24-22(26)23-15)17-8-10-18(11-9-17)29-14-16-6-4-3-5-7-16/h3-11,19-20H,1,12-14H2,2H3,(H2,23,24,26)/t19-,20+/m1/s1