(2S,4S)-4-(4-iodophenyl)-2-(4-oxidanylbutoxy)-3,4-dihydro-2H-pyran-6-carboxylic acid

Systemtic Name: (2S,4S)-4-(4-iodophenyl)-2-(4-oxidanylbutoxy)-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: (2S,4S)-2-(4-hydroxybutoxy)-4-(4-iodophenyl)-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: (2S,4S)-2-(4-hydroxybutoxy)-4-(4-iodophenyl)-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: (2S,4S)-2-(4-hydroxybutoxy)-4-(4-iodophenyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: (2S,4S)-2-(4-hydroxybutoxy)-4-(4-iodophenyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C16H19IO5 MolecularWeight: 418.22353

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=C(OC1OCCCCO)C(=O)O)C2=CC=C(C=C2)I

Isomeric SMILES

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

InChI

InChI=1S/C16H19IO5/c17-13-5-3-11(4-6-13)12-9-14(16(19)20)22-15(10-12)21-8-2-1-7-18/h3-6,9,12,15,18H,1-2,7-8,10H2,(H,19,20)/t12-,15+/m1/s1