[2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl] 4,5-bis(bromanyl)thiophene-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl] 4,5-bis(bromanyl)thiophene-2-carboxylate Openeye Name: [2-oxo-2-(4-phenylazoanilino)ethyl] 4,5-dibromothiophene-2-carboxylate CAS Name: 4,5-dibromo-2-thiophenecarboxylic acid [2-oxo-2-(4-phenyldiazenylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenyldiazenylanilino)ethyl] 4,5-dibromothiophene-2-carboxylate Traditional Name: 4,5-dibromothiophene-2-carboxylic acid [2-keto-2-(4-phenylazoanilino)ethyl] ester Formula: C19H13Br2N3O3S MolecularWeight: 523.19782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=O)COC(=O)C3=CC(=C(S3)Br)Br

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=O)COC(=O)C3=CC(=C(S3)Br)Br

InChI

InChI=1S/C19H13Br2N3O3S/c20-15-10-16(28-18(15)21)19(26)27-11-17(25)22-12-6-8-14(9-7-12)24-23-13-4-2-1-3-5-13/h1-10H,11H2,(H,22,25)