4-methoxy-3-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)sulfonyl]benzoic acid

Systemtic Name: 4-methoxy-3-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)sulfonyl]benzoic acid Openeye Name: 4-methoxy-3-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)sulfonyl]benzoic acid CAS Name: 4-methoxy-3-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)sulfonyl]benzoic acid IUPAC Name: 4-methoxy-3-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)sulfonyl]benzoic acid Traditional Name: 4-methoxy-3-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)sulfonyl]benzoic acid Formula: C16H17NO5S2 MolecularWeight: 367.43988

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(CCN1S(=O)(=O)C3=C(C=CC(=C3)C(=O)O)OC)SC=C2

Isomeric SMILES

CC1C2=C(CCN1S(=O)(=O)C3=C(C=CC(=C3)C(=O)O)OC)SC=C2

InChI

InChI=1S/C16H17NO5S2/c1-10-12-6-8-23-14(12)5-7-17(10)24(20,21)15-9-11(16(18)19)3-4-13(15)22-2/h3-4,6,8-10H,5,7H2,1-2H3,(H,18,19)