methyl 2-(5-chloranyl-3-cyano-2-oxidanylidene-1H-indol-3-yl)-2-cyano-ethanoate

Systemtic Name: methyl 2-(5-chloranyl-3-cyano-2-oxidanylidene-1H-indol-3-yl)-2-cyano-ethanoate Openeye Name: methyl 2-(5-chloro-3-cyano-2-oxo-indolin-3-yl)-2-cyano-acetate CAS Name: 2-(5-chloro-3-cyano-2-oxo-1H-indol-3-yl)-2-cyanoacetic acid methyl ester IUPAC Name: methyl 2-(5-chloro-3-cyano-2-oxo-1H-indol-3-yl)-2-cyanoacetate Traditional Name: 2-(5-chloro-3-cyano-2-keto-indolin-3-yl)-2-cyano-acetic acid methyl ester Formula: C13H8ClN3O3 MolecularWeight: 289.67392

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#N)C1(C2=C(C=CC(=C2)Cl)NC1=O)C#N

Isomeric SMILES

COC(=O)C(C#N)C1(C2=C(C=CC(=C2)Cl)NC1=O)C#N

InChI

InChI=1S/C13H8ClN3O3/c1-20-11(18)9(5-15)13(6-16)8-4-7(14)2-3-10(8)17-12(13)19/h2-4,9H,1H3,(H,17,19)