2-propoxyethyl (4S,5R)-4-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: 2-propoxyethyl (4S,5R)-4-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: 2-propoxyethyl (4S,5R)-4-(3-chloro-4-hydroxy-5-methoxy-phenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4S,5R)-4-(3-chloro-4-hydroxy-5-methoxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid 2-propoxyethyl ester IUPAC Name: 2-propoxyethyl (4S,5R)-4-(3-chloro-4-hydroxy-5-methoxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4S,5R)-4-(3-chloro-4-hydroxy-5-methoxy-phenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid 2-propoxyethyl ester Formula: C18H23ClN2O6 MolecularWeight: 398.83802

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCCOC(=O)C1C(NC(=O)NC1=C)C2=CC(=C(C(=C2)Cl)O)OC

Isomeric SMILES

CCCOCCOC(=O)[C@@H]1[C@H](NC(=O)NC1=C)C2=CC(=C(C(=C2)Cl)O)OC

InChI

InChI=1S/C18H23ClN2O6/c1-4-5-26-6-7-27-17(23)14-10(2)20-18(24)21-15(14)11-8-12(19)16(22)13(9-11)25-3/h8-9,14-15,22H,2,4-7H2,1,3H3,(H2,20,21,24)/t14-,15+/m0/s1