4-bromanyl-5-pentadecyl-benzene-1,2-diol

Systemtic Name: 4-bromanyl-5-pentadecyl-benzene-1,2-diol Openeye Name: 4-bromo-5-pentadecyl-benzene-1,2-diol CAS Name: 4-bromo-5-pentadecylbenzene-1,2-diol IUPAC Name: 4-bromo-5-pentadecylbenzene-1,2-diol Traditional Name: 4-bromo-5-pentadecyl-pyrocatechol Formula: C21H35BrO2 MolecularWeight: 399.4054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC(=C(C=C1Br)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC(=C(C=C1Br)O)O

InChI

InChI=1S/C21H35BrO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-16-20(23)21(24)17-19(18)22/h16-17,23-24H,2-15H2,1H3