3-(4-chlorophenyl)-2-(2-methyl-1-oxidanyl-propan-2-yl)-3-oxidanyl-isoindol-1-one

Systemtic Name: 3-(4-chlorophenyl)-2-(2-methyl-1-oxidanyl-propan-2-yl)-3-oxidanyl-isoindol-1-one Openeye Name: 3-(4-chlorophenyl)-3-hydroxy-2-(2-hydroxy-1,1-dimethyl-ethyl)isoindolin-1-one CAS Name: 3-(4-chlorophenyl)-3-hydroxy-2-(1-hydroxy-2-methylpropan-2-yl)-1-isoindolone IUPAC Name: 3-(4-chlorophenyl)-3-hydroxy-2-(1-hydroxy-2-methylpropan-2-yl)isoindol-1-one Traditional Name: 3-(4-chlorophenyl)-3-hydroxy-2-(2-hydroxy-1,1-dimethyl-ethyl)isoindolin-1-one Formula: C18H18ClNO3 MolecularWeight: 331.79342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)N1C(=O)C2=CC=CC=C2C1(C3=CC=C(C=C3)Cl)O

Isomeric SMILES

CC(C)(CO)N1C(=O)C2=CC=CC=C2C1(C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C18H18ClNO3/c1-17(2,11-21)20-16(22)14-5-3-4-6-15(14)18(20,23)12-7-9-13(19)10-8-12/h3-10,21,23H,11H2,1-2H3