6,8-bis(chloranyl)-3-[3-(3-nitrophenoxy)-2-oxidanyl-propyl]quinazolin-4-one

Systemtic Name: 6,8-bis(chloranyl)-3-[3-(3-nitrophenoxy)-2-oxidanyl-propyl]quinazolin-4-one Openeye Name: 6,8-dichloro-3-[2-hydroxy-3-(3-nitrophenoxy)propyl]quinazolin-4-one CAS Name: 6,8-dichloro-3-[2-hydroxy-3-(3-nitrophenoxy)propyl]-4-quinazolinone IUPAC Name: 6,8-dichloro-3-[2-hydroxy-3-(3-nitrophenoxy)propyl]quinazolin-4-one Traditional Name: 6,8-dichloro-3-[2-hydroxy-3-(3-nitrophenoxy)propyl]quinazolin-4-one Formula: C17H13Cl2N3O5 MolecularWeight: 410.20822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13Cl2N3O5/c18-10-4-14-16(15(19)5-10)20-9-21(17(14)24)7-12(23)8-27-13-3-1-2-11(6-13)22(25)26/h1-6,9,12,23H,7-8H2