ethyl (2R)-3-azanylidene-3-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-2-cyano-propanoate

Systemtic Name: ethyl (2R)-3-azanylidene-3-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-2-cyano-propanoate Openeye Name: ethyl (2R)-3-(6-bromo-2-oxo-chromen-3-yl)-2-cyano-3-imino-propanoate CAS Name: (2R)-3-(6-bromo-2-oxo-1-benzopyran-3-yl)-2-cyano-3-iminopropanoic acid ethyl ester IUPAC Name: ethyl (2R)-3-(6-bromo-2-oxochromen-3-yl)-2-cyano-3-iminopropanoate Traditional Name: (2R)-3-(6-bromo-2-keto-chromen-3-yl)-2-cyano-3-imino-propionic acid ethyl ester Formula: C15H11BrN2O4 MolecularWeight: 363.16284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(=N)C1=CC2=C(C=CC(=C2)Br)OC1=O

Isomeric SMILES

CCOC(=O)[C@@H](C#N)C(=N)C1=CC2=C(C=CC(=C2)Br)OC1=O

InChI

InChI=1S/C15H11BrN2O4/c1-2-21-14(19)11(7-17)13(18)10-6-8-5-9(16)3-4-12(8)22-15(10)20/h3-6,11,18H,2H2,1H3/t11-/m0/s1