5-[(4-bromophenyl)amino]-6-chloranyl-2-(hydroxymethyl)-1-benzothiophene-4,7-dione

Systemtic Name: 5-[(4-bromophenyl)amino]-6-chloranyl-2-(hydroxymethyl)-1-benzothiophene-4,7-dione Openeye Name: 5-(4-bromoanilino)-6-chloro-2-(hydroxymethyl)benzothiophene-4,7-dione CAS Name: 5-(4-bromoanilino)-6-chloro-2-(hydroxymethyl)-1-benzothiophene-4,7-dione IUPAC Name: 5-(4-bromoanilino)-6-chloro-2-(hydroxymethyl)-1-benzothiophene-4,7-dione Traditional Name: 5-(4-bromoanilino)-6-chloro-2-methylol-benzothiophene-4,7-quinone Formula: C15H9BrClNO3S MolecularWeight: 398.65886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=C(C(=O)C3=C(C2=O)C=C(S3)CO)Cl)Br

Isomeric SMILES

C1=CC(=CC=C1NC2=C(C(=O)C3=C(C2=O)C=C(S3)CO)Cl)Br

InChI

InChI=1S/C15H9BrClNO3S/c16-7-1-3-8(4-2-7)18-12-11(17)14(21)15-10(13(12)20)5-9(6-19)22-15/h1-5,18-19H,6H2