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

Systemtic Name: butyl (4S,5R)-4-(3,4-dichlorophenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: butyl (4S,5R)-4-(3,4-dichlorophenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4S,5R)-4-(3,4-dichlorophenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid butyl ester IUPAC Name: butyl (4S,5R)-4-(3,4-dichlorophenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4S,5R)-4-(3,4-dichlorophenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid butyl ester Formula: C16H18Cl2N2O3 MolecularWeight: 357.23172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1C(NC(=O)NC1=C)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C16H18Cl2N2O3/c1-3-4-7-23-15(21)13-9(2)19-16(22)20-14(13)10-5-6-11(17)12(18)8-10/h5-6,8,13-14H,2-4,7H2,1H3,(H2,19,20,22)/t13-,14+/m0/s1