3-[3-[2,4-bis(chloranyl)phenoxy]-2-oxidanyl-propyl]-7-chloranyl-6-nitro-quinazolin-4-one

Systemtic Name: 3-[3-[2,4-bis(chloranyl)phenoxy]-2-oxidanyl-propyl]-7-chloranyl-6-nitro-quinazolin-4-one Openeye Name: 7-chloro-3-[3-(2,4-dichlorophenoxy)-2-hydroxy-propyl]-6-nitro-quinazolin-4-one CAS Name: 7-chloro-3-[3-(2,4-dichlorophenoxy)-2-hydroxypropyl]-6-nitro-4-quinazolinone IUPAC Name: 7-chloro-3-[3-(2,4-dichlorophenoxy)-2-hydroxypropyl]-6-nitroquinazolin-4-one Traditional Name: 7-chloro-3-[3-(2,4-dichlorophenoxy)-2-hydroxy-propyl]-6-nitro-quinazolin-4-one Formula: C17H12Cl3N3O5 MolecularWeight: 444.65328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)OCC(CN2C=NC3=CC(=C(C=C3C2=O)[N+](=O)[O-])Cl)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)OCC(CN2C=NC3=CC(=C(C=C3C2=O)[N+](=O)[O-])Cl)O

InChI

InChI=1S/C17H12Cl3N3O5/c18-9-1-2-16(13(20)3-9)28-7-10(24)6-22-8-21-14-5-12(19)15(23(26)27)4-11(14)17(22)25/h1-5,8,10,24H,6-7H2