1-(4-chloranyl-2-methyl-phenyl)-3-oxidanylidene-1,2-diazinane-4-carboxylic acid

Systemtic Name: 1-(4-chloranyl-2-methyl-phenyl)-3-oxidanylidene-1,2-diazinane-4-carboxylic acid Openeye Name: 1-(4-chloro-2-methyl-phenyl)-3-oxo-hexahydropyridazine-4-carboxylic acid CAS Name: 1-(4-chloro-2-methylphenyl)-3-oxo-4-diazinanecarboxylic acid IUPAC Name: 1-(4-chloro-2-methylphenyl)-3-oxodiazinane-4-carboxylic acid Traditional Name: 1-(4-chloro-2-methyl-phenyl)-3-keto-hexahydropyridazine-4-carboxylic acid Formula: C12H13ClN2O3 MolecularWeight: 268.69622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)N2CCC(C(=O)N2)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)N2CCC(C(=O)N2)C(=O)O

InChI

InChI=1S/C12H13ClN2O3/c1-7-6-8(13)2-3-10(7)15-5-4-9(12(17)18)11(16)14-15/h2-3,6,9H,4-5H2,1H3,(H,14,16)(H,17,18)