2-(hydroxymethyl)-5-[(4-methoxyphenyl)amino]-1-benzothiophene-4,7-dione

Systemtic Name: 2-(hydroxymethyl)-5-[(4-methoxyphenyl)amino]-1-benzothiophene-4,7-dione Openeye Name: 2-(hydroxymethyl)-5-(4-methoxyanilino)benzothiophene-4,7-dione CAS Name: 2-(hydroxymethyl)-5-(4-methoxyanilino)-1-benzothiophene-4,7-dione IUPAC Name: 2-(hydroxymethyl)-5-(4-methoxyanilino)-1-benzothiophene-4,7-dione Traditional Name: 2-methylol-5-(p-anisidino)benzothiophene-4,7-quinone Formula: C16H13NO4S MolecularWeight: 315.34372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=CC(=O)C3=C(C2=O)C=C(S3)CO

Isomeric SMILES

COC1=CC=C(C=C1)NC2=CC(=O)C3=C(C2=O)C=C(S3)CO

InChI

InChI=1S/C16H13NO4S/c1-21-10-4-2-9(3-5-10)17-13-7-14(19)16-12(15(13)20)6-11(8-18)22-16/h2-7,17-18H,8H2,1H3