2-butylquinoline-6-sulfonic acid

Systemtic Name: 2-butylquinoline-6-sulfonic acid Openeye Name: 2-butylquinoline-6-sulfonic acid CAS Name: 2-butyl-6-quinolinesulfonic acid IUPAC Name: 2-butylquinoline-6-sulfonic acid Traditional Name: 2-butylquinoline-6-sulfonic acid Formula: C13H15NO3S MolecularWeight: 265.3281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=C1)C=C(C=C2)S(=O)(=O)O

Isomeric SMILES

CCCCC1=NC2=C(C=C1)C=C(C=C2)S(=O)(=O)O

InChI

InChI=1S/C13H15NO3S/c1-2-3-4-11-6-5-10-9-12(18(15,16)17)7-8-13(10)14-11/h5-9H,2-4H2,1H3,(H,15,16,17)