5-nitro-2-(2-propoxyethoxy)benzenesulfonic acid

Systemtic Name: 5-nitro-2-(2-propoxyethoxy)benzenesulfonic acid Openeye Name: 5-nitro-2-(2-propoxyethoxy)benzenesulfonic acid CAS Name: 5-nitro-2-(2-propoxyethoxy)benzenesulfonic acid IUPAC Name: 5-nitro-2-(2-propoxyethoxy)benzenesulfonic acid Traditional Name: 5-nitro-2-(2-propoxyethoxy)besylic acid Formula: C11H15NO7S MolecularWeight: 305.3043

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCCOC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)O

Isomeric SMILES

CCCOCCOC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C11H15NO7S/c1-2-5-18-6-7-19-10-4-3-9(12(13)14)8-11(10)20(15,16)17/h3-4,8H,2,5-7H2,1H3,(H,15,16,17)