5-(4-chloranylphenoxy)-5-methyl-2,3-bis(oxidanyl)-1-pyridin-3-yl-hexane-1,4-dione

Systemtic Name: 5-(4-chloranylphenoxy)-5-methyl-2,3-bis(oxidanyl)-1-pyridin-3-yl-hexane-1,4-dione Openeye Name: 5-(4-chlorophenoxy)-2,3-dihydroxy-5-methyl-1-(3-pyridyl)hexane-1,4-dione CAS Name: 5-(4-chlorophenoxy)-2,3-dihydroxy-5-methyl-1-(3-pyridinyl)hexane-1,4-dione IUPAC Name: 5-(4-chlorophenoxy)-2,3-dihydroxy-5-methyl-1-pyridin-3-ylhexane-1,4-dione Traditional Name: 5-(4-chlorophenoxy)-2,3-dihydroxy-5-methyl-1-(3-pyridyl)hexane-1,4-dione Formula: C18H18ClNO5 MolecularWeight: 363.79222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C(C(C(=O)C1=CN=CC=C1)O)O)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C(=O)C(C(C(=O)C1=CN=CC=C1)O)O)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H18ClNO5/c1-18(2,25-13-7-5-12(19)6-8-13)17(24)16(23)15(22)14(21)11-4-3-9-20-10-11/h3-10,15-16,22-23H,1-2H3