ethyl 6-azanyl-5-cyano-4-[2-(cyanomethoxy)phenyl]-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-5-cyano-4-[2-(cyanomethoxy)phenyl]-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-5-cyano-4-[2-(cyanomethoxy)phenyl]-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-[2-(cyanomethoxy)phenyl]-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-5-cyano-4-[2-(cyanomethoxy)phenyl]-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-4-[2-(cyanomethoxy)phenyl]-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2OCC#N)C#N)N)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2OCC#N)C#N)N)C

InChI

InChI=1S/C18H17N3O4/c1-3-23-18(22)15-11(2)25-17(21)13(10-20)16(15)12-6-4-5-7-14(12)24-9-8-19/h4-7,16H,3,9,21H2,1-2H3