2-[5-cyano-3,4-bis(3,4-dichlorophenyl)-6-oxidanylidene-pyridazin-1-yl]ethanoic acid

Systemtic Name: 2-[5-cyano-3,4-bis(3,4-dichlorophenyl)-6-oxidanylidene-pyridazin-1-yl]ethanoic acid Openeye Name: 2-[5-cyano-3,4-bis(3,4-dichlorophenyl)-6-oxo-pyridazin-1-yl]acetic acid CAS Name: 2-[5-cyano-3,4-bis(3,4-dichlorophenyl)-6-oxo-1-pyridazinyl]acetic acid IUPAC Name: 2-[5-cyano-3,4-bis(3,4-dichlorophenyl)-6-oxopyridazin-1-yl]acetic acid Traditional Name: 2-[5-cyano-3,4-bis(3,4-dichlorophenyl)-6-keto-pyridazin-1-yl]acetic acid Formula: C19H9Cl4N3O3 MolecularWeight: 469.10506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=C(C(=O)N(N=C2C3=CC(=C(C=C3)Cl)Cl)CC(=O)O)C#N)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1C2=C(C(=O)N(N=C2C3=CC(=C(C=C3)Cl)Cl)CC(=O)O)C#N)Cl)Cl

InChI

InChI=1S/C19H9Cl4N3O3/c20-12-3-1-9(5-14(12)22)17-11(7-24)19(29)26(8-16(27)28)25-18(17)10-2-4-13(21)15(23)6-10/h1-6H,8H2,(H,27,28)