3-quinolin-8-yloxypropane-1-sulfonic acid

Systemtic Name: 3-quinolin-8-yloxypropane-1-sulfonic acid Openeye Name: 3-(8-quinolyloxy)propane-1-sulfonic acid CAS Name: 3-(8-quinolinyloxy)-1-propanesulfonic acid IUPAC Name: 3-quinolin-8-yloxypropane-1-sulfonic acid Traditional Name: 3-(8-quinolyloxy)propane-1-sulfonic acid Formula: C12H13NO4S MolecularWeight: 267.30092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)OCCCS(=O)(=O)O)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)OCCCS(=O)(=O)O)N=CC=C2

InChI

InChI=1S/C12H13NO4S/c14-18(15,16)9-3-8-17-11-6-1-4-10-5-2-7-13-12(10)11/h1-2,4-7H,3,8-9H2,(H,14,15,16)