2-(4-chlorophenyl)-2-methyl-5-oxidanylidene-4-propyl-pyridazin-2-ium-3-carboxylic acid

Systemtic Name: 2-(4-chlorophenyl)-2-methyl-5-oxidanylidene-4-propyl-pyridazin-2-ium-3-carboxylic acid Openeye Name: 2-(4-chlorophenyl)-2-methyl-5-oxo-4-propyl-pyridazin-2-ium-3-carboxylic acid CAS Name: 2-(4-chlorophenyl)-2-methyl-5-oxo-4-propyl-3-pyridazin-2-iumcarboxylic acid IUPAC Name: 2-(4-chlorophenyl)-2-methyl-5-oxo-4-propylpyridazin-2-ium-3-carboxylic acid Traditional Name: 2-(4-chlorophenyl)-5-keto-2-methyl-4-propyl-pyridazin-2-ium-3-carboxylic acid Formula: C15H16ClN2O3+ MolecularWeight: 307.75214

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C([N+](N=CC1=O)(C)C2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CCCC1=C([N+](N=CC1=O)(C)C2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C15H15ClN2O3/c1-3-4-12-13(19)9-17-18(2,14(12)15(20)21)11-7-5-10(16)6-8-11/h5-9H,3-4H2,1-2H3/p+1