2-(oxan-4-ylsulfonylmethyl)-5-phenyl-pentanoic acid

Systemtic Name: 2-(oxan-4-ylsulfonylmethyl)-5-phenyl-pentanoic acid Openeye Name: 5-phenyl-2-(tetrahydropyran-4-ylsulfonylmethyl)pentanoic acid CAS Name: 2-(4-oxanylsulfonylmethyl)-5-phenylpentanoic acid IUPAC Name: 2-(oxan-4-ylsulfonylmethyl)-5-phenylpentanoic acid Traditional Name: 5-phenyl-2-(tetrahydropyran-4-ylsulfonylmethyl)valeric acid Formula: C17H24O5S MolecularWeight: 340.43446

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1S(=O)(=O)CC(CCCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1COCCC1S(=O)(=O)CC(CCCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H24O5S/c18-17(19)15(8-4-7-14-5-2-1-3-6-14)13-23(20,21)16-9-11-22-12-10-16/h1-3,5-6,15-16H,4,7-13H2,(H,18,19)