3-acetyloxy-6-methoxy-2-phenyl-1-benzothiophene-2,3-dicarboxylic acid

Systemtic Name: 3-acetyloxy-6-methoxy-2-phenyl-1-benzothiophene-2,3-dicarboxylic acid Openeye Name: 3-acetoxy-6-methoxy-2-phenyl-benzothiophene-2,3-dicarboxylic acid CAS Name: 3-acetyloxy-6-methoxy-2-phenyl-1-benzothiophene-2,3-dicarboxylic acid IUPAC Name: 3-acetyloxy-6-methoxy-2-phenyl-1-benzothiophene-2,3-dicarboxylic acid Traditional Name: 3-acetoxy-6-methoxy-2-phenyl-benzothiophene-2,3-dicarboxylic acid Formula: C19H16O7S MolecularWeight: 388.39114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(C2=C(C=C(C=C2)OC)SC1(C3=CC=CC=C3)C(=O)O)C(=O)O

Isomeric SMILES

CC(=O)OC1(C2=C(C=C(C=C2)OC)SC1(C3=CC=CC=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C19H16O7S/c1-11(20)26-18(16(21)22)14-9-8-13(25-2)10-15(14)27-19(18,17(23)24)12-6-4-3-5-7-12/h3-10H,1-2H3,(H,21,22)(H,23,24)