4,6-dibutyl-3-chloranyl-benzene-1,2-diolate

Systemtic Name: 4,6-dibutyl-3-chloranyl-benzene-1,2-diolate Openeye Name: 4,6-dibutyl-3-chloro-benzene-1,2-diolate CAS Name: 4,6-dibutyl-3-chlorobenzene-1,2-diolate IUPAC Name: 4,6-dibutyl-3-chlorobenzene-1,2-diolate Traditional Name: 4,6-dibutyl-3-chloro-benzene-1,2-diolate Formula: C14H19ClO2-2 MolecularWeight: 254.75246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C(=C1[O-])[O-])Cl)CCCC

Isomeric SMILES

CCCCC1=CC(=C(C(=C1[O-])[O-])Cl)CCCC

InChI

InChI=1S/C14H21ClO2/c1-3-5-7-10-9-11(8-6-4-2)13(16)14(17)12(10)15/h9,16-17H,3-8H2,1-2H3/p-2