methyl 5-[(4-bromophenyl)amino]-6-chloranyl-4,7-bis(oxidanylidene)-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-[(4-bromophenyl)amino]-6-chloranyl-4,7-bis(oxidanylidene)-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-(4-bromoanilino)-6-chloro-4,7-dioxo-benzothiophene-2-carboxylate CAS Name: 5-(4-bromoanilino)-6-chloro-4,7-dioxo-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-bromoanilino)-6-chloro-4,7-dioxo-1-benzothiophene-2-carboxylate Traditional Name: 5-(4-bromoanilino)-6-chloro-4,7-diketo-benzothiophene-2-carboxylic acid methyl ester Formula: C16H9BrClNO4S MolecularWeight: 426.66896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(S1)C(=O)C(=C(C2=O)NC3=CC=C(C=C3)Br)Cl

Isomeric SMILES

COC(=O)C1=CC2=C(S1)C(=O)C(=C(C2=O)NC3=CC=C(C=C3)Br)Cl

InChI

InChI=1S/C16H9BrClNO4S/c1-23-16(22)10-6-9-13(20)12(11(18)14(21)15(9)24-10)19-8-4-2-7(17)3-5-8/h2-6,19H,1H3