[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl] 3,6-bis(chloranyl)-1-benzothiophene-2-carboxylate

Systemtic Name: [2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl] 3,6-bis(chloranyl)-1-benzothiophene-2-carboxylate Openeye Name: [2-(2-bromoanilino)-2-oxo-ethyl] 3,6-dichlorobenzothiophene-2-carboxylate CAS Name: 3,6-dichloro-1-benzothiophene-2-carboxylic acid [2-(2-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-bromoanilino)-2-oxoethyl] 3,6-dichloro-1-benzothiophene-2-carboxylate Traditional Name: 3,6-dichlorobenzothiophene-2-carboxylic acid [2-(2-bromoanilino)-2-keto-ethyl] ester Formula: C17H10BrCl2NO3S MolecularWeight: 459.1412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)COC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)Br

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)COC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)Br

InChI

InChI=1S/C17H10BrCl2NO3S/c18-11-3-1-2-4-12(11)21-14(22)8-24-17(23)16-15(20)10-6-5-9(19)7-13(10)25-16/h1-7H,8H2,(H,21,22)