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

Systemtic Name: (4-methoxyphenyl)methyl (4R,5S)-4-(3-chloranyl-4-methoxy-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: (4-methoxyphenyl)methyl (4R,5S)-4-(3-chloro-4-methoxy-phenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4R,5S)-4-(3-chloro-4-methoxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl (4R,5S)-4-(3-chloro-4-methoxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4R,5S)-4-(3-chloro-4-methoxy-phenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid p-anisyl ester Formula: C21H21ClN2O5 MolecularWeight: 416.85484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC(=O)C2C(NC(=O)NC2=C)C3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

COC1=CC=C(C=C1)COC(=O)[C@H]2[C@@H](NC(=O)NC2=C)C3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C21H21ClN2O5/c1-12-18(20(25)29-11-13-4-7-15(27-2)8-5-13)19(24-21(26)23-12)14-6-9-17(28-3)16(22)10-14/h4-10,18-19H,1,11H2,2-3H3,(H2,23,24,26)/t18-,19+/m1/s1