6-nitro-3-(3-oxidanylpropyl)quinazolin-4-one

Systemtic Name: 6-nitro-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 3-(3-hydroxypropyl)-6-nitro-quinazolin-4-one CAS Name: 3-(3-hydroxypropyl)-6-nitro-4-quinazolinone IUPAC Name: 3-(3-hydroxypropyl)-6-nitroquinazolin-4-one Traditional Name: 3-(3-hydroxypropyl)-6-nitro-quinazolin-4-one Formula: C11H11N3O4 MolecularWeight: 249.22274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C=N2)CCCO

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C=N2)CCCO

InChI

InChI=1S/C11H11N3O4/c15-5-1-4-13-7-12-10-3-2-8(14(17)18)6-9(10)11(13)16/h2-3,6-7,15H,1,4-5H2