6-nitro-7-(3-oxidanylpiperidin-1-yl)-1H-quinazolin-4-one

Systemtic Name: 6-nitro-7-(3-oxidanylpiperidin-1-yl)-1H-quinazolin-4-one Openeye Name: 7-(3-hydroxy-1-piperidyl)-6-nitro-1H-quinazolin-4-one CAS Name: 7-(3-hydroxy-1-piperidinyl)-6-nitro-1H-quinazolin-4-one IUPAC Name: 7-(3-hydroxypiperidin-1-yl)-6-nitro-1H-quinazolin-4-one Traditional Name: 7-(3-hydroxypiperidino)-6-nitro-1H-quinazolin-4-one Formula: C13H14N4O4 MolecularWeight: 290.27466

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=C3C(=C2)NC=NC3=O)[N+](=O)[O-])O

Isomeric SMILES

C1CC(CN(C1)C2=C(C=C3C(=C2)NC=NC3=O)[N+](=O)[O-])O

InChI

InChI=1S/C13H14N4O4/c18-8-2-1-3-16(6-8)11-5-10-9(4-12(11)17(20)21)13(19)15-7-14-10/h4-5,7-8,18H,1-3,6H2,(H,14,15,19)