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

Systemtic Name: 3,6-dibutyl-4-chloranyl-benzene-1,2-diol Openeye Name: 3,6-dibutyl-4-chloro-benzene-1,2-diol CAS Name: 3,6-dibutyl-4-chlorobenzene-1,2-diol IUPAC Name: 3,6-dibutyl-4-chlorobenzene-1,2-diol Traditional Name: 3,6-dibutyl-4-chloro-pyrocatechol Formula: C14H21ClO2 MolecularWeight: 256.76834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C(=C1O)O)CCCC)Cl

Isomeric SMILES

CCCCC1=CC(=C(C(=C1O)O)CCCC)Cl

InChI

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