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

Systemtic Name: ethyl 6-azanyl-4-[5-bromanyl-2-(cyanomethoxy)phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-[5-bromo-2-(cyanomethoxy)phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-4-[5-bromo-2-(cyanomethoxy)phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-[5-bromo-2-(cyanomethoxy)phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-[5-bromo-2-(cyanomethoxy)phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C18H16BrN3O4 MolecularWeight: 418.24134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=C(C=CC(=C2)Br)OCC#N)C#N)N)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=C(C=CC(=C2)Br)OCC#N)C#N)N)C

InChI

InChI=1S/C18H16BrN3O4/c1-3-24-18(23)15-10(2)26-17(22)13(9-21)16(15)12-8-11(19)4-5-14(12)25-7-6-20/h4-5,8,16H,3,7,22H2,1-2H3