benzene-1,2,3-triol; 1-phenylethanone

Systemtic Name: benzene-1,2,3-triol; 1-phenylethanone Openeye Name: benzene-1,2,3-triol; 1-phenylethanone CAS Name: benzene-1,2,3-triol; 1-phenylethanone IUPAC Name: benzene-1,2,3-triol; 1-phenylethanone Traditional Name: acetophenone; pyrogallol Formula: C14H14O4 MolecularWeight: 246.25856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1.C1=CC(=C(C(=C1)O)O)O

Isomeric SMILES

CC(=O)C1=CC=CC=C1.C1=CC(=C(C(=C1)O)O)O

InChI

InChI=1S/C8H8O.C6H6O3/c1-7(9)8-5-3-2-4-6-8;7-4-2-1-3-5(8)6(4)9/h2-6H,1H3;1-3,7-9H