7-(butylamino)-6-nitro-1H-quinazolin-4-one

Systemtic Name: 7-(butylamino)-6-nitro-1H-quinazolin-4-one Openeye Name: 7-(butylamino)-6-nitro-1H-quinazolin-4-one CAS Name: 7-(butylamino)-6-nitro-1H-quinazolin-4-one IUPAC Name: 7-(butylamino)-6-nitro-1H-quinazolin-4-one Traditional Name: 7-(butylamino)-6-nitro-1H-quinazolin-4-one Formula: C12H14N4O3 MolecularWeight: 262.26456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C2C(=C1)NC=NC2=O)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=C(C=C2C(=C1)NC=NC2=O)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O3/c1-2-3-4-13-10-6-9-8(5-11(10)16(18)19)12(17)15-7-14-9/h5-7,13H,2-4H2,1H3,(H,14,15,17)