3-butyl-4-phenyl-benzene-1,2-diol

Systemtic Name: 3-butyl-4-phenyl-benzene-1,2-diol Openeye Name: 3-butyl-4-phenyl-benzene-1,2-diol CAS Name: 3-butyl-4-phenylbenzene-1,2-diol IUPAC Name: 3-butyl-4-phenylbenzene-1,2-diol Traditional Name: 3-butyl-4-phenyl-pyrocatechol Formula: C16H18O2 MolecularWeight: 242.31292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1O)O)C2=CC=CC=C2

Isomeric SMILES

CCCCC1=C(C=CC(=C1O)O)C2=CC=CC=C2

InChI

InChI=1S/C16H18O2/c1-2-3-9-14-13(10-11-15(17)16(14)18)12-7-5-4-6-8-12/h4-8,10-11,17-18H,2-3,9H2,1H3