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

Systemtic Name: ethyl 6-azanyl-4-(3-bromanyl-4-prop-2-ynoxy-phenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-(3-bromo-4-prop-2-ynoxy-phenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-4-(3-bromo-4-prop-2-ynoxyphenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-(3-bromo-4-prop-2-ynoxyphenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-(3-bromo-4-propargyloxy-phenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C19H17BrN2O4 MolecularWeight: 417.25328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17BrN2O4/c1-4-8-25-15-7-6-12(9-14(15)20)17-13(10-21)18(22)26-11(3)16(17)19(23)24-5-2/h1,6-7,9,17H,5,8,22H2,2-3H3