6-chloranyl-2-(hydroxymethyl)-5-phenylazanyl-1-benzothiophene-4,7-dione

Systemtic Name: 6-chloranyl-2-(hydroxymethyl)-5-phenylazanyl-1-benzothiophene-4,7-dione Openeye Name: 5-anilino-6-chloro-2-(hydroxymethyl)benzothiophene-4,7-dione CAS Name: 5-anilino-6-chloro-2-(hydroxymethyl)-1-benzothiophene-4,7-dione IUPAC Name: 5-anilino-6-chloro-2-(hydroxymethyl)-1-benzothiophene-4,7-dione Traditional Name: 5-anilino-6-chloro-2-methylol-benzothiophene-4,7-quinone Formula: C15H10ClNO3S MolecularWeight: 319.7628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C(C(=O)C3=C(C2=O)C=C(S3)CO)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC2=C(C(=O)C3=C(C2=O)C=C(S3)CO)Cl

InChI

InChI=1S/C15H10ClNO3S/c16-11-12(17-8-4-2-1-3-5-8)13(19)10-6-9(7-18)21-15(10)14(11)20/h1-6,17-18H,7H2