methyl 2-azanyl-3-cyano-quinoline-4-carboxylate

Systemtic Name: methyl 2-azanyl-3-cyano-quinoline-4-carboxylate Openeye Name: methyl 2-amino-3-cyano-quinoline-4-carboxylate CAS Name: 2-amino-3-cyano-4-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-amino-3-cyanoquinoline-4-carboxylate Traditional Name: 2-amino-3-cyano-cinchoninic acid methyl ester Formula: C12H9N3O2 MolecularWeight: 227.21876

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=NC2=CC=CC=C21)N)C#N

Isomeric SMILES

COC(=O)C1=C(C(=NC2=CC=CC=C21)N)C#N

InChI

InChI=1S/C12H9N3O2/c1-17-12(16)10-7-4-2-3-5-9(7)15-11(14)8(10)6-13/h2-5H,1H3,(H2,14,15)