2-(4-chloranylphenoxy)-4,4-dimethyl-1-oxidanyl-1-pyridin-3-yl-pentan-3-one

Systemtic Name: 2-(4-chloranylphenoxy)-4,4-dimethyl-1-oxidanyl-1-pyridin-3-yl-pentan-3-one Openeye Name: 2-(4-chlorophenoxy)-1-hydroxy-4,4-dimethyl-1-(3-pyridyl)pentan-3-one CAS Name: 2-(4-chlorophenoxy)-1-hydroxy-4,4-dimethyl-1-(3-pyridinyl)-3-pentanone IUPAC Name: 2-(4-chlorophenoxy)-1-hydroxy-4,4-dimethyl-1-pyridin-3-ylpentan-3-one Traditional Name: 2-(4-chlorophenoxy)-1-hydroxy-4,4-dimethyl-1-(3-pyridyl)pentan-3-one Formula: C18H20ClNO3 MolecularWeight: 333.8093

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClNO3/c1-18(2,3)17(22)16(15(21)12-5-4-10-20-11-12)23-14-8-6-13(19)7-9-14/h4-11,15-16,21H,1-3H3