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

Systemtic Name: ethyl (4S)-6-azanyl-4-(3-bromanyl-4,5-dimethoxy-phenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl (4S)-6-amino-4-(3-bromo-4,5-dimethoxy-phenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate CAS Name: (4S)-6-amino-4-(3-bromo-4,5-dimethoxyphenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-amino-4-(3-bromo-4,5-dimethoxyphenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Traditional Name: (4S)-6-amino-4-(3-bromo-4,5-dimethoxy-phenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C18H19BrN2O5 MolecularWeight: 423.25786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C1=C(OC(=C([C@@H]1C2=CC(=C(C(=C2)Br)OC)OC)C#N)N)C

InChI

InChI=1S/C18H19BrN2O5/c1-5-25-18(22)14-9(2)26-17(21)11(8-20)15(14)10-6-12(19)16(24-4)13(7-10)23-3/h6-7,15H,5,21H2,1-4H3/t15-/m0/s1