2-quinolin-8-ylsulfinyloctanoic acid

Systemtic Name: 2-quinolin-8-ylsulfinyloctanoic acid Openeye Name: 2-(8-quinolylsulfinyl)octanoic acid CAS Name: 2-(8-quinolinylsulfinyl)octanoic acid IUPAC Name: 2-quinolin-8-ylsulfinyloctanoic acid Traditional Name: 2-(8-quinolylsulfinyl)caprylic acid Formula: C17H21NO3S MolecularWeight: 319.41854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)S(=O)C1=CC=CC2=C1N=CC=C2

Isomeric SMILES

CCCCCCC(C(=O)O)S(=O)C1=CC=CC2=C1N=CC=C2

InChI

InChI=1S/C17H21NO3S/c1-2-3-4-5-10-15(17(19)20)22(21)14-11-6-8-13-9-7-12-18-16(13)14/h6-9,11-12,15H,2-5,10H2,1H3,(H,19,20)