Molecule ID: 439469

IUPAC Name: 4-(3,5-dichloro-4-hydroxyphenyl)imino-2,3-dihydronaphthalen-1-one

Description: The molecule is a member of the class of imines that is 2,3-dihydro-1,4-naphthoquinone imine in which the imine hydrogen has been replaced by a 3,5-dichloro-4-hydroxyphenyl group. It is a member of tetralins, an imine, a chlorophenol and a dichlorobenzene.

SMILES: O=C1CCC(=Nc2cc(Cl)c(O)c(Cl)c2)c2ccccc21

SELFIES: [O][=C][C][C][C][=Branch2][Ring1][Ring1][=N][C][=C][C][Branch1][C][Cl][=C][Branch1][C][O][C][Branch1][C][Cl][=C][Ring1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][Ring2]

InChI: InChI=1S/C16H11Cl2NO2/c17-12-7-9(8-13(18)16(12)21)19-14-5-6-15(20)11-4-2-1-3-10(11)14/h1-4,7-8,21H,5-6H2

Molecular Properties:
- Polar Surface Area: 49.7 Ų
- LogP: 3.9