1-[2,4-bis(oxidanyl)-5-propyl-phenyl]-2-pyridin-2-yl-ethanone

Systemtic Name: 1-[2,4-bis(oxidanyl)-5-propyl-phenyl]-2-pyridin-2-yl-ethanone Openeye Name: 1-(2,4-dihydroxy-5-propyl-phenyl)-2-(2-pyridyl)ethanone CAS Name: 1-(2,4-dihydroxy-5-propylphenyl)-2-(2-pyridinyl)ethanone IUPAC Name: 1-(2,4-dihydroxy-5-propylphenyl)-2-pyridin-2-ylethanone Traditional Name: 1-(2,4-dihydroxy-5-propyl-phenyl)-2-(2-pyridyl)ethanone Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C(=C1)C(=O)CC2=CC=CC=N2)O)O

Isomeric SMILES

CCCC1=C(C=C(C(=C1)C(=O)CC2=CC=CC=N2)O)O

InChI

InChI=1S/C16H17NO3/c1-2-5-11-8-13(16(20)10-14(11)18)15(19)9-12-6-3-4-7-17-12/h3-4,6-8,10,18,20H,2,5,9H2,1H3