3-(2-chloranylhexan-2-yl)benzene-1,2-diolate

Systemtic Name: 3-(2-chloranylhexan-2-yl)benzene-1,2-diolate Openeye Name: 3-(1-chloro-1-methyl-pentyl)benzene-1,2-diolate CAS Name: 3-(2-chlorohexan-2-yl)benzene-1,2-diolate IUPAC Name: 3-(2-chlorohexan-2-yl)benzene-1,2-diolate Traditional Name: 3-(1-chloro-1-methyl-pentyl)benzene-1,2-diolate Formula: C12H15ClO2-2 MolecularWeight: 226.6993

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C1=C(C(=CC=C1)[O-])[O-])Cl

Isomeric SMILES

CCCCC(C)(C1=C(C(=CC=C1)[O-])[O-])Cl

InChI

InChI=1S/C12H17ClO2/c1-3-4-8-12(2,13)9-6-5-7-10(14)11(9)15/h5-7,14-15H,3-4,8H2,1-2H3/p-2