methyl 1-ethanoyl-4-methylidene-2-oxidanylidene-6-(3-phenoxyphenyl)-1,3-diazinane-5-carboxylate

Systemtic Name: methyl 1-ethanoyl-4-methylidene-2-oxidanylidene-6-(3-phenoxyphenyl)-1,3-diazinane-5-carboxylate Openeye Name: methyl 1-acetyl-4-methylene-2-oxo-6-(3-phenoxyphenyl)hexahydropyrimidine-5-carboxylate CAS Name: 1-acetyl-4-methylene-2-oxo-6-(3-phenoxyphenyl)-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl 1-acetyl-4-methylidene-2-oxo-6-(3-phenoxyphenyl)-1,3-diazinane-5-carboxylate Traditional Name: 1-acetyl-2-keto-4-methylene-6-(3-phenoxyphenyl)hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C(C(=C)NC1=O)C(=O)OC)C2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(=O)N1C(C(C(=C)NC1=O)C(=O)OC)C2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O5/c1-13-18(20(25)27-3)19(23(14(2)24)21(26)22-13)15-8-7-11-17(12-15)28-16-9-5-4-6-10-16/h4-12,18-19H,1H2,2-3H3,(H,22,26)