2-chloranyl-5-[(5-cyano-4-methyl-6-oxidanidyl-2-oxidanylidene-1-propyl-pyridin-3-yl)diazenyl]benzoate

Systemtic Name: 2-chloranyl-5-[(5-cyano-4-methyl-6-oxidanidyl-2-oxidanylidene-1-propyl-pyridin-3-yl)diazenyl]benzoate Openeye Name: 2-chloro-5-[(5-cyano-4-methyl-6-oxido-2-oxo-1-propyl-3-pyridyl)azo]benzoate CAS Name: 2-chloro-5-[(5-cyano-4-methyl-6-oxido-2-oxo-1-propyl-3-pyridinyl)azo]benzoate IUPAC Name: 2-chloro-5-[(5-cyano-4-methyl-6-oxido-2-oxo-1-propylpyridin-3-yl)diazenyl]benzoate Traditional Name: 2-chloro-5-[(5-cyano-2-keto-4-methyl-6-oxido-1-propyl-3-pyridyl)azo]benzoate Formula: C17H13ClN4O4-2 MolecularWeight: 372.76252

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=C(C1=O)N=NC2=CC(=C(C=C2)Cl)C(=O)[O-])C)C#N)[O-]

Isomeric SMILES

CCCN1C(=C(C(=C(C1=O)N=NC2=CC(=C(C=C2)Cl)C(=O)[O-])C)C#N)[O-]

InChI

InChI=1S/C17H15ClN4O4/c1-3-6-22-15(23)12(8-19)9(2)14(16(22)24)21-20-10-4-5-13(18)11(7-10)17(25)26/h4-5,7,23H,3,6H2,1-2H3,(H,25,26)/p-2