(2R,4R)-4-(1-benzothiophen-3-yl)-2-(4-oxidanylbutoxy)-3,4-dihydro-2H-pyran-6-carboxylic acid

Systemtic Name: (2R,4R)-4-(1-benzothiophen-3-yl)-2-(4-oxidanylbutoxy)-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: (2R,4R)-4-(benzothiophen-3-yl)-2-(4-hydroxybutoxy)-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: (2R,4R)-4-(1-benzothiophen-3-yl)-2-(4-hydroxybutoxy)-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: (2R,4R)-4-(1-benzothiophen-3-yl)-2-(4-hydroxybutoxy)-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: (2R,4R)-4-(benzothiophen-3-yl)-2-(4-hydroxybutoxy)-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C18H20O5S MolecularWeight: 348.4134

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=C(OC1OCCCCO)C(=O)O)C2=CSC3=CC=CC=C32

Isomeric SMILES

C1[C@H](C=C(O[C@H]1OCCCCO)C(=O)O)C2=CSC3=CC=CC=C32

InChI

InChI=1S/C18H20O5S/c19-7-3-4-8-22-17-10-12(9-15(23-17)18(20)21)14-11-24-16-6-2-1-5-13(14)16/h1-2,5-6,9,11-12,17,19H,3-4,7-8,10H2,(H,20,21)/t12-,17+/m0/s1