methyl (4R,5S)-4-[3-(4-chloranylphenoxy)phenyl]-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: methyl (4R,5S)-4-[3-(4-chloranylphenoxy)phenyl]-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: methyl (4R,5S)-4-[3-(4-chlorophenoxy)phenyl]-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4R,5S)-4-[3-(4-chlorophenoxy)phenyl]-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl (4R,5S)-4-[3-(4-chlorophenoxy)phenyl]-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4R,5S)-4-[3-(4-chlorophenoxy)phenyl]-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C19H17ClN2O4 MolecularWeight: 372.80228

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(NC(=O)NC1=C)C2=CC(=CC=C2)OC3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)[C@H]1[C@@H](NC(=O)NC1=C)C2=CC(=CC=C2)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H17ClN2O4/c1-11-16(18(23)25-2)17(22-19(24)21-11)12-4-3-5-15(10-12)26-14-8-6-13(20)7-9-14/h3-10,16-17H,1H2,2H3,(H2,21,22,24)/t16-,17+/m1/s1