tert-butyl (4R,5S)-4-(4-methoxycarbonylphenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: tert-butyl (4R,5S)-4-(4-methoxycarbonylphenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: tert-butyl (4R,5S)-4-(4-methoxycarbonylphenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4R,5S)-4-(4-methoxycarbonylphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4R,5S)-4-(4-methoxycarbonylphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4R,5S)-4-(4-carbomethoxyphenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid tert-butyl ester Formula: C18H22N2O5 MolecularWeight: 346.37768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O5/c1-10-13(16(22)25-18(2,3)4)14(20-17(23)19-10)11-6-8-12(9-7-11)15(21)24-5/h6-9,13-14H,1H2,2-5H3,(H2,19,20,23)/t13-,14+/m1/s1