[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 2-[(3-bromophenyl)carbonylamino]ethanoate

Systemtic Name: [2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 2-[(3-bromophenyl)carbonylamino]ethanoate Openeye Name: [2-(3-cyanoanilino)-2-oxo-ethyl] 2-[(3-bromobenzoyl)amino]acetate CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]acetic acid [2-(3-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-cyanoanilino)-2-oxoethyl] 2-[(3-bromobenzoyl)amino]acetate Traditional Name: 2-[(3-bromobenzoyl)amino]acetic acid [2-(3-cyanoanilino)-2-keto-ethyl] ester Formula: C18H14BrN3O4 MolecularWeight: 416.22546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14BrN3O4/c19-14-5-2-4-13(8-14)18(25)21-10-17(24)26-11-16(23)22-15-6-1-3-12(7-15)9-20/h1-8H,10-11H2,(H,21,25)(H,22,23)