ethyl 6-azanyl-4-(5-bromanyl-2-prop-2-enoxy-phenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-4-(5-bromanyl-2-prop-2-enoxy-phenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl 4-(2-allyloxy-5-bromo-phenyl)-6-amino-5-cyano-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-4-(5-bromo-2-prop-2-enoxyphenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-(5-bromo-2-prop-2-enoxyphenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Traditional Name: 4-(2-allyloxy-5-bromo-phenyl)-6-amino-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C19H19BrN2O4 MolecularWeight: 419.26916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrN2O4/c1-4-8-25-15-7-6-12(20)9-13(15)17-14(10-21)18(22)26-11(3)16(17)19(23)24-5-2/h4,6-7,9,17H,1,5,8,22H2,2-3H3