4-[3-(4-chlorophenyl)-6-oxidanylidene-4,5-dihydropyridazin-1-yl]but-2-ynoic acid

Systemtic Name: 4-[3-(4-chlorophenyl)-6-oxidanylidene-4,5-dihydropyridazin-1-yl]but-2-ynoic acid Openeye Name: 4-[3-(4-chlorophenyl)-6-oxo-4,5-dihydropyridazin-1-yl]but-2-ynoic acid CAS Name: 4-[3-(4-chlorophenyl)-6-oxo-4,5-dihydropyridazin-1-yl]-2-butynoic acid IUPAC Name: 4-[3-(4-chlorophenyl)-6-oxo-4,5-dihydropyridazin-1-yl]but-2-ynoic acid Traditional Name: 4-[3-(4-chlorophenyl)-6-keto-4,5-dihydropyridazin-1-yl]but-2-ynoic acid Formula: C14H11ClN2O3 MolecularWeight: 290.70174

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(N=C1C2=CC=C(C=C2)Cl)CC#CC(=O)O

Isomeric SMILES

C1CC(=O)N(N=C1C2=CC=C(C=C2)Cl)CC#CC(=O)O

InChI

InChI=1S/C14H11ClN2O3/c15-11-5-3-10(4-6-11)12-7-8-13(18)17(16-12)9-1-2-14(19)20/h3-6H,7-9H2,(H,19,20)