methyl 4-[3-methoxy-4-(phenylcarbonyloxy)phenyl]-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: methyl 4-[3-methoxy-4-(phenylcarbonyloxy)phenyl]-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: methyl 4-(4-benzoyloxy-3-methoxy-phenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: 4-(4-benzoyloxy-3-methoxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-benzoyloxy-3-methoxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: 4-(4-benzoyloxy-3-methoxy-phenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C(C(=C)NC(=O)N2)C(=O)OC)OC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C2C(C(=C)NC(=O)N2)C(=O)OC)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O6/c1-12-17(20(25)28-3)18(23-21(26)22-12)14-9-10-15(16(11-14)27-2)29-19(24)13-7-5-4-6-8-13/h4-11,17-18H,1H2,2-3H3,(H2,22,23,26)