tert-butyl (4S,5R)-4-(5-chloranyl-2-ethoxy-3-methoxy-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: tert-butyl (4S,5R)-4-(5-chloranyl-2-ethoxy-3-methoxy-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: tert-butyl (4S,5R)-4-(5-chloro-2-ethoxy-3-methoxy-phenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4S,5R)-4-(5-chloro-2-ethoxy-3-methoxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4S,5R)-4-(5-chloro-2-ethoxy-3-methoxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4S,5R)-4-(5-chloro-2-ethoxy-3-methoxy-phenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid tert-butyl ester Formula: C19H25ClN2O5 MolecularWeight: 396.8652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1C2C(C(=C)NC(=O)N2)C(=O)OC(C)(C)C)Cl)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1[C@@H]2[C@H](C(=C)NC(=O)N2)C(=O)OC(C)(C)C)Cl)OC

InChI

InChI=1S/C19H25ClN2O5/c1-7-26-16-12(8-11(20)9-13(16)25-6)15-14(10(2)21-18(24)22-15)17(23)27-19(3,4)5/h8-9,14-15H,2,7H2,1,3-6H3,(H2,21,22,24)/t14-,15+/m0/s1