benzene-1,2-diol; 2-[3-fluoranyl-4,5-bis(oxidanyl)phenyl]ethanenitrile

Systemtic Name: benzene-1,2-diol; 2-[3-fluoranyl-4,5-bis(oxidanyl)phenyl]ethanenitrile Openeye Name: benzene-1,2-diol; 2-(3-fluoro-4,5-dihydroxy-phenyl)acetonitrile CAS Name: benzene-1,2-diol; 2-(3-fluoro-4,5-dihydroxyphenyl)acetonitrile IUPAC Name: benzene-1,2-diol; 2-(3-fluoro-4,5-dihydroxyphenyl)acetonitrile Traditional Name: 2-(3-fluoro-4,5-dihydroxy-phenyl)acetonitrile; pyrocatechol Formula: C14H12FNO4 MolecularWeight: 277.247783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)O)O.C1=C(C=C(C(=C1O)O)F)CC#N

Isomeric SMILES

C1=CC=C(C(=C1)O)O.C1=C(C=C(C(=C1O)O)F)CC#N

InChI

InChI=1S/C8H6FNO2.C6H6O2/c9-6-3-5(1-2-10)4-7(11)8(6)12;7-5-3-1-2-4-6(5)8/h3-4,11-12H,1H2;1-4,7-8H