ethyl 6-azanyl-4-(5-bromanyl-2,4-dimethoxy-phenyl)-5-cyano-2-propyl-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-4-(5-bromanyl-2,4-dimethoxy-phenyl)-5-cyano-2-propyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-(5-bromo-2,4-dimethoxy-phenyl)-5-cyano-2-propyl-4H-pyran-3-carboxylate CAS Name: 6-amino-4-(5-bromo-2,4-dimethoxyphenyl)-5-cyano-2-propyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-(5-bromo-2,4-dimethoxyphenyl)-5-cyano-2-propyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-(5-bromo-2,4-dimethoxy-phenyl)-5-cyano-2-propyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C20H23BrN2O5 MolecularWeight: 451.31102

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(C(=C(O1)N)C#N)C2=CC(=C(C=C2OC)OC)Br)C(=O)OCC

Isomeric SMILES

CCCC1=C(C(C(=C(O1)N)C#N)C2=CC(=C(C=C2OC)OC)Br)C(=O)OCC

InChI

InChI=1S/C20H23BrN2O5/c1-5-7-14-18(20(24)27-6-2)17(12(10-22)19(23)28-14)11-8-13(21)16(26-4)9-15(11)25-3/h8-9,17H,5-7,23H2,1-4H3