[2-[(2-cyano-1-benzofuran-3-yl)amino]-2-oxidanylidene-ethyl] 5-bromanyl-1H-indole-3-carboxylate

Systemtic Name: [2-[(2-cyano-1-benzofuran-3-yl)amino]-2-oxidanylidene-ethyl] 5-bromanyl-1H-indole-3-carboxylate Openeye Name: [2-[(2-cyanobenzofuran-3-yl)amino]-2-oxo-ethyl] 5-bromo-1H-indole-3-carboxylate CAS Name: 5-bromo-1H-indole-3-carboxylic acid [2-[(2-cyano-3-benzofuranyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-cyano-1-benzofuran-3-yl)amino]-2-oxoethyl] 5-bromo-1H-indole-3-carboxylate Traditional Name: 5-bromo-1H-indole-3-carboxylic acid [2-[(2-cyanobenzofuran-3-yl)amino]-2-keto-ethyl] ester Formula: C20H12BrN3O4 MolecularWeight: 438.23098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(O2)C#N)NC(=O)COC(=O)C3=CNC4=C3C=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(O2)C#N)NC(=O)COC(=O)C3=CNC4=C3C=C(C=C4)Br

InChI

InChI=1S/C20H12BrN3O4/c21-11-5-6-15-13(7-11)14(9-23-15)20(26)27-10-18(25)24-19-12-3-1-2-4-16(12)28-17(19)8-22/h1-7,9,23H,10H2,(H,24,25)