ethyl (4R)-2-azanyl-6-bromanyl-4-[(1R)-1-cyano-2-ethoxy-2-oxidanylidene-ethyl]-4H-chromene-3-carboxylate

Systemtic Name: ethyl (4R)-2-azanyl-6-bromanyl-4-[(1R)-1-cyano-2-ethoxy-2-oxidanylidene-ethyl]-4H-chromene-3-carboxylate Openeye Name: ethyl (4R)-2-amino-6-bromo-4-[(1R)-1-cyano-2-ethoxy-2-oxo-ethyl]-4H-chromene-3-carboxylate CAS Name: (4R)-2-amino-6-bromo-4-[(1R)-1-cyano-2-ethoxy-2-oxoethyl]-4H-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-2-amino-6-bromo-4-[(1R)-1-cyano-2-ethoxy-2-oxoethyl]-4H-chromene-3-carboxylate Traditional Name: (4R)-2-amino-6-bromo-4-[(1R)-1-cyano-2-ethoxy-2-keto-ethyl]-4H-chromene-3-carboxylic acid ethyl ester Formula: C17H17BrN2O5 MolecularWeight: 409.23128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C1C(C#N)C(=O)OCC)C=C(C=C2)Br)N

Isomeric SMILES

CCOC(=O)C1=C(OC2=C([C@H]1[C@H](C#N)C(=O)OCC)C=C(C=C2)Br)N

InChI

InChI=1S/C17H17BrN2O5/c1-3-23-16(21)11(8-19)13-10-7-9(18)5-6-12(10)25-15(20)14(13)17(22)24-4-2/h5-7,11,13H,3-4,20H2,1-2H3/t11-,13-/m0/s1