4-(4-chloranyl-5-ethanoyl-3,6-dimethyl-1H-pyridazin-2-yl)benzoic acid

Systemtic Name: 4-(4-chloranyl-5-ethanoyl-3,6-dimethyl-1H-pyridazin-2-yl)benzoic acid Openeye Name: 4-(5-acetyl-4-chloro-3,6-dimethyl-1H-pyridazin-2-yl)benzoic acid CAS Name: 4-(5-acetyl-4-chloro-3,6-dimethyl-1H-pyridazin-2-yl)benzoic acid IUPAC Name: 4-(5-acetyl-4-chloro-3,6-dimethyl-1H-pyridazin-2-yl)benzoic acid Traditional Name: 4-(5-acetyl-4-chloro-3,6-dimethyl-1H-pyridazin-2-yl)benzoic acid Formula: C15H15ClN2O3 MolecularWeight: 306.7442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N(N1)C2=CC=C(C=C2)C(=O)O)C)Cl)C(=O)C

Isomeric SMILES

CC1=C(C(=C(N(N1)C2=CC=C(C=C2)C(=O)O)C)Cl)C(=O)C

InChI

InChI=1S/C15H15ClN2O3/c1-8-13(10(3)19)14(16)9(2)18(17-8)12-6-4-11(5-7-12)15(20)21/h4-7,17H,1-3H3,(H,20,21)