6-butyl-4-oxidanyl-naphthalene-1-sulfonic acid

Systemtic Name: 6-butyl-4-oxidanyl-naphthalene-1-sulfonic acid Openeye Name: 6-butyl-4-hydroxy-naphthalene-1-sulfonic acid CAS Name: 6-butyl-4-hydroxy-1-naphthalenesulfonic acid IUPAC Name: 6-butyl-4-hydroxynaphthalene-1-sulfonic acid Traditional Name: 6-butyl-4-hydroxy-naphthalene-1-sulfonic acid Formula: C14H16O4S MolecularWeight: 280.33944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=CC(=C2C=C1)S(=O)(=O)O)O

Isomeric SMILES

CCCCC1=CC2=C(C=CC(=C2C=C1)S(=O)(=O)O)O

InChI

InChI=1S/C14H16O4S/c1-2-3-4-10-5-6-11-12(9-10)13(15)7-8-14(11)19(16,17)18/h5-9,15H,2-4H2,1H3,(H,16,17,18)