(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-[(5-bromofuran-2-carbonyl)amino]acetate CAS Name: 2-[[(5-bromo-2-furanyl)-oxomethyl]amino]acetic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-[(5-bromofuran-2-carbonyl)amino]acetate Traditional Name: 2-[(5-bromo-2-furoyl)amino]acetic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C13H12BrN3O5 MolecularWeight: 370.15548

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)CNC(=O)C1=CC=C(O1)Br

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)CNC(=O)C1=CC=C(O1)Br

InChI

InChI=1S/C13H12BrN3O5/c1-7(16)8(4-15)9(18)6-21-12(19)5-17-13(20)10-2-3-11(14)22-10/h2-3,8,16H,5-6H2,1H3,(H,17,20)