2-(2-chloranyl-4-methyl-phenyl)-5-oxidanylidene-3-(phenylmethyl)pyridazine-4-carboxylic acid

Systemtic Name: 2-(2-chloranyl-4-methyl-phenyl)-5-oxidanylidene-3-(phenylmethyl)pyridazine-4-carboxylic acid Openeye Name: 3-benzyl-2-(2-chloro-4-methyl-phenyl)-5-oxo-pyridazine-4-carboxylic acid CAS Name: 2-(2-chloro-4-methylphenyl)-5-oxo-3-(phenylmethyl)-4-pyridazinecarboxylic acid IUPAC Name: 3-benzyl-2-(2-chloro-4-methylphenyl)-5-oxopyridazine-4-carboxylic acid Traditional Name: 3-benzyl-2-(2-chloro-4-methyl-phenyl)-5-keto-pyridazine-4-carboxylic acid Formula: C19H15ClN2O3 MolecularWeight: 354.787

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=C(C(=O)C=N2)C(=O)O)CC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=C(C(=O)C=N2)C(=O)O)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C19H15ClN2O3/c1-12-7-8-15(14(20)9-12)22-16(10-13-5-3-2-4-6-13)18(19(24)25)17(23)11-21-22/h2-9,11H,10H2,1H3,(H,24,25)