4-[5-chloranyl-4-(ethylamino)-6-oxidanylidene-pyridazin-1-yl]benzoic acid

Systemtic Name: 4-[5-chloranyl-4-(ethylamino)-6-oxidanylidene-pyridazin-1-yl]benzoic acid Openeye Name: 4-[5-chloro-4-(ethylamino)-6-oxo-pyridazin-1-yl]benzoic acid CAS Name: 4-[5-chloro-4-(ethylamino)-6-oxo-1-pyridazinyl]benzoic acid IUPAC Name: 4-[5-chloro-4-(ethylamino)-6-oxopyridazin-1-yl]benzoic acid Traditional Name: 4-[5-chloro-4-(ethylamino)-6-keto-pyridazin-1-yl]benzoic acid Formula: C13H12ClN3O3 MolecularWeight: 293.70568

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C(=O)N(N=C1)C2=CC=C(C=C2)C(=O)O)Cl

Isomeric SMILES

CCNC1=C(C(=O)N(N=C1)C2=CC=C(C=C2)C(=O)O)Cl

InChI

InChI=1S/C13H12ClN3O3/c1-2-15-10-7-16-17(12(18)11(10)14)9-5-3-8(4-6-9)13(19)20/h3-7,15H,2H2,1H3,(H,19,20)