3-azanyl-5-octoxy-benzenesulfonic acid

Systemtic Name: 3-azanyl-5-octoxy-benzenesulfonic acid Openeye Name: 3-amino-5-octoxy-benzenesulfonic acid CAS Name: 3-amino-5-octoxybenzenesulfonic acid IUPAC Name: 3-amino-5-octoxybenzenesulfonic acid Traditional Name: 3-amino-5-octoxy-besylic acid Formula: C14H23NO4S MolecularWeight: 301.40172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=CC(=C1)N)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCOC1=CC(=CC(=C1)N)S(=O)(=O)O

InChI

InChI=1S/C14H23NO4S/c1-2-3-4-5-6-7-8-19-13-9-12(15)10-14(11-13)20(16,17)18/h9-11H,2-8,15H2,1H3,(H,16,17,18)