3-(5-cyano-6-oxidanylidene-3,4-diphenyl-pyridazin-1-yl)propanoic acid

Systemtic Name: 3-(5-cyano-6-oxidanylidene-3,4-diphenyl-pyridazin-1-yl)propanoic acid Openeye Name: 3-(5-cyano-6-oxo-3,4-diphenyl-pyridazin-1-yl)propanoic acid CAS Name: 3-(5-cyano-6-oxo-3,4-diphenyl-1-pyridazinyl)propanoic acid IUPAC Name: 3-(5-cyano-6-oxo-3,4-diphenylpyridazin-1-yl)propanoic acid Traditional Name: 3-(5-cyano-6-keto-3,4-diphenyl-pyridazin-1-yl)propionic acid Formula: C20H15N3O3 MolecularWeight: 345.3514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)N(N=C2C3=CC=CC=C3)CCC(=O)O)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)N(N=C2C3=CC=CC=C3)CCC(=O)O)C#N

InChI

InChI=1S/C20H15N3O3/c21-13-16-18(14-7-3-1-4-8-14)19(15-9-5-2-6-10-15)22-23(20(16)26)12-11-17(24)25/h1-10H,11-12H2,(H,24,25)