7-[3-(2-azanyl-2-oxidanylidene-ethoxy)-4-methoxy-phenyl]-5-oxidanylidene-3-phenyl-6,7-dihydro-4H-thieno[3,2-b]pyridine-2-carboxylic acid

Systemtic Name: 7-[3-(2-azanyl-2-oxidanylidene-ethoxy)-4-methoxy-phenyl]-5-oxidanylidene-3-phenyl-6,7-dihydro-4H-thieno[3,2-b]pyridine-2-carboxylic acid Openeye Name: 7-[3-(2-amino-2-oxo-ethoxy)-4-methoxy-phenyl]-5-oxo-3-phenyl-6,7-dihydro-4H-thieno[3,2-b]pyridine-2-carboxylic acid CAS Name: 7-[3-(2-amino-2-oxoethoxy)-4-methoxyphenyl]-5-oxo-3-phenyl-6,7-dihydro-4H-thieno[3,2-b]pyridine-2-carboxylic acid IUPAC Name: 7-[3-(2-amino-2-oxoethoxy)-4-methoxyphenyl]-5-oxo-3-phenyl-6,7-dihydro-4H-thieno[3,2-b]pyridine-2-carboxylic acid Traditional Name: 7-[3-(2-amino-2-keto-ethoxy)-4-methoxy-phenyl]-5-keto-3-phenyl-6,7-dihydro-4H-thieno[3,2-b]pyridine-2-carboxylic acid Formula: C23H20N2O6S MolecularWeight: 452.4797

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=O)NC3=C2SC(=C3C4=CC=CC=C4)C(=O)O)OCC(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(=O)NC3=C2SC(=C3C4=CC=CC=C4)C(=O)O)OCC(=O)N

InChI

InChI=1S/C23H20N2O6S/c1-30-15-8-7-13(9-16(15)31-11-17(24)26)14-10-18(27)25-20-19(12-5-3-2-4-6-12)22(23(28)29)32-21(14)20/h2-9,14H,10-11H2,1H3,(H2,24,26)(H,25,27)(H,28,29)