5-morpholin-4-yl-1-benzothiophene-2,3-dicarboxylic acid

Systemtic Name: 5-morpholin-4-yl-1-benzothiophene-2,3-dicarboxylic acid Openeye Name: 5-morpholinobenzothiophene-2,3-dicarboxylic acid CAS Name: 5-(4-morpholinyl)-1-benzothiophene-2,3-dicarboxylic acid IUPAC Name: 5-morpholin-4-yl-1-benzothiophene-2,3-dicarboxylic acid Traditional Name: 5-morpholinobenzothiophene-2,3-dicarboxylic acid Formula: C14H13NO5S MolecularWeight: 307.32172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC3=C(C=C2)SC(=C3C(=O)O)C(=O)O

Isomeric SMILES

C1COCCN1C2=CC3=C(C=C2)SC(=C3C(=O)O)C(=O)O

InChI

InChI=1S/C14H13NO5S/c16-13(17)11-9-7-8(15-3-5-20-6-4-15)1-2-10(9)21-12(11)14(18)19/h1-2,7H,3-6H2,(H,16,17)(H,18,19)