6-butyl-1-(4-chlorophenyl)-4-oxidanylidene-pyridazin-1-ium-1-carboxylic acid

Systemtic Name: 6-butyl-1-(4-chlorophenyl)-4-oxidanylidene-pyridazin-1-ium-1-carboxylic acid Openeye Name: 6-butyl-1-(4-chlorophenyl)-4-oxo-pyridazin-1-ium-1-carboxylic acid CAS Name: 6-butyl-1-(4-chlorophenyl)-4-oxo-1-pyridazin-1-iumcarboxylic acid IUPAC Name: 6-butyl-1-(4-chlorophenyl)-4-oxopyridazin-1-ium-1-carboxylic acid Traditional Name: 6-butyl-1-(4-chlorophenyl)-4-keto-pyridazin-1-ium-1-carboxylic acid Formula: C15H16ClN2O3+ MolecularWeight: 307.75214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)C=N[N+]1(C2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CCCCC1=CC(=O)C=N[N+]1(C2=CC=C(C=C2)Cl)C(=O)O

InChI

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