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

Systemtic Name: methyl (4R,5S)-4-[3,5-bis(chloranyl)-4-prop-2-enoxy-phenyl]-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: methyl (4R,5S)-4-(4-allyloxy-3,5-dichloro-phenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4R,5S)-4-(3,5-dichloro-4-prop-2-enoxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl (4R,5S)-4-(3,5-dichloro-4-prop-2-enoxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4R,5S)-4-(4-allyloxy-3,5-dichloro-phenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C16H16Cl2N2O4 MolecularWeight: 371.21524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16Cl2N2O4/c1-4-5-24-14-10(17)6-9(7-11(14)18)13-12(15(21)23-3)8(2)19-16(22)20-13/h4,6-7,12-13H,1-2,5H2,3H3,(H2,19,20,22)/t12-,13+/m1/s1