ethyl (2R)-3-[4-[(4-bromophenyl)carbonylamino]phenyl]-2-cyano-3-oxidanylidene-propanoate

Systemtic Name: ethyl (2R)-3-[4-[(4-bromophenyl)carbonylamino]phenyl]-2-cyano-3-oxidanylidene-propanoate Openeye Name: ethyl (2R)-3-[4-[(4-bromobenzoyl)amino]phenyl]-2-cyano-3-oxo-propanoate CAS Name: (2R)-3-[4-[[(4-bromophenyl)-oxomethyl]amino]phenyl]-2-cyano-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl (2R)-3-[4-[(4-bromobenzoyl)amino]phenyl]-2-cyano-3-oxopropanoate Traditional Name: (2R)-3-[4-[(4-bromobenzoyl)amino]phenyl]-2-cyano-3-keto-propionic acid ethyl ester Formula: C19H15BrN2O4 MolecularWeight: 415.2374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15BrN2O4/c1-2-26-19(25)16(11-21)17(23)12-5-9-15(10-6-12)22-18(24)13-3-7-14(20)8-4-13/h3-10,16H,2H2,1H3,(H,22,24)/t16-/m1/s1