3-[3-[2,6-bis(chloranyl)phenoxy]-2-oxidanyl-propyl]-6-chloranyl-quinazolin-4-one

Systemtic Name: 3-[3-[2,6-bis(chloranyl)phenoxy]-2-oxidanyl-propyl]-6-chloranyl-quinazolin-4-one Openeye Name: 6-chloro-3-[3-(2,6-dichlorophenoxy)-2-hydroxy-propyl]quinazolin-4-one CAS Name: 6-chloro-3-[3-(2,6-dichlorophenoxy)-2-hydroxypropyl]-4-quinazolinone IUPAC Name: 6-chloro-3-[3-(2,6-dichlorophenoxy)-2-hydroxypropyl]quinazolin-4-one Traditional Name: 6-chloro-3-[3-(2,6-dichlorophenoxy)-2-hydroxy-propyl]quinazolin-4-one Formula: C17H13Cl3N2O3 MolecularWeight: 399.65572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)OCC(CN2C=NC3=C(C2=O)C=C(C=C3)Cl)O)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)OCC(CN2C=NC3=C(C2=O)C=C(C=C3)Cl)O)Cl

InChI

InChI=1S/C17H13Cl3N2O3/c18-10-4-5-15-12(6-10)17(24)22(9-21-15)7-11(23)8-25-16-13(19)2-1-3-14(16)20/h1-6,9,11,23H,7-8H2