2-azanyl-4-hexoxy-benzenesulfonic acid

Systemtic Name: 2-azanyl-4-hexoxy-benzenesulfonic acid Openeye Name: 2-amino-4-hexoxy-benzenesulfonic acid CAS Name: 2-amino-4-hexoxybenzenesulfonic acid IUPAC Name: 2-amino-4-hexoxybenzenesulfonic acid Traditional Name: 2-amino-4-hexoxy-besylic acid Formula: C12H19NO4S MolecularWeight: 273.34856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC(=C(C=C1)S(=O)(=O)O)N

Isomeric SMILES

CCCCCCOC1=CC(=C(C=C1)S(=O)(=O)O)N

InChI

InChI=1S/C12H19NO4S/c1-2-3-4-5-8-17-10-6-7-12(11(13)9-10)18(14,15)16/h6-7,9H,2-5,8,13H2,1H3,(H,14,15,16)