3-(1-butoxypropyl)benzene-1,2-diolate

Systemtic Name: 3-(1-butoxypropyl)benzene-1,2-diolate Openeye Name: 3-(1-butoxypropyl)benzene-1,2-diolate CAS Name: 3-(1-butoxypropyl)benzene-1,2-diolate IUPAC Name: 3-(1-butoxypropyl)benzene-1,2-diolate Traditional Name: 3-(1-butoxypropyl)benzene-1,2-diolate Formula: C13H18O3-2 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(CC)C1=C(C(=CC=C1)[O-])[O-]

Isomeric SMILES

CCCCOC(CC)C1=C(C(=CC=C1)[O-])[O-]

InChI

InChI=1S/C13H20O3/c1-3-5-9-16-12(4-2)10-7-6-8-11(14)13(10)15/h6-8,12,14-15H,3-5,9H2,1-2H3/p-2