methyl 2-[(4-chlorophenyl)carbamoyl]-6-oxidanylidene-1,2-diazinane-4-carboxylate

Systemtic Name: methyl 2-[(4-chlorophenyl)carbamoyl]-6-oxidanylidene-1,2-diazinane-4-carboxylate Openeye Name: methyl 2-[(4-chlorophenyl)carbamoyl]-6-oxo-hexahydropyridazine-4-carboxylate CAS Name: 2-[(4-chloroanilino)-oxomethyl]-6-oxo-4-diazinanecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-chlorophenyl)carbamoyl]-6-oxodiazinane-4-carboxylate Traditional Name: 2-[(4-chlorophenyl)carbamoyl]-6-keto-hexahydropyridazine-4-carboxylic acid methyl ester Formula: C13H14ClN3O4 MolecularWeight: 311.72096

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(=O)NN(C1)C(=O)NC2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)C1CC(=O)NN(C1)C(=O)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H14ClN3O4/c1-21-12(19)8-6-11(18)16-17(7-8)13(20)15-10-4-2-9(14)3-5-10/h2-5,8H,6-7H2,1H3,(H,15,20)(H,16,18)