5-azanyl-2-propoxy-benzenesulfonic acid

Systemtic Name: 5-azanyl-2-propoxy-benzenesulfonic acid Openeye Name: 5-amino-2-propoxy-benzenesulfonic acid CAS Name: 5-amino-2-propoxybenzenesulfonic acid IUPAC Name: 5-amino-2-propoxybenzenesulfonic acid Traditional Name: 5-amino-2-propoxy-besylic acid Formula: C9H13NO4S MolecularWeight: 231.26882

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)N)S(=O)(=O)O

Isomeric SMILES

CCCOC1=C(C=C(C=C1)N)S(=O)(=O)O

InChI

InChI=1S/C9H13NO4S/c1-2-5-14-8-4-3-7(10)6-9(8)15(11,12)13/h3-4,6H,2,5,10H2,1H3,(H,11,12,13)