6-(3-methylbutylamino)-5-nitro-1H-pyrimidin-4-one

Systemtic Name: 6-(3-methylbutylamino)-5-nitro-1H-pyrimidin-4-one Openeye Name: 6-(isopentylamino)-5-nitro-1H-pyrimidin-4-one CAS Name: 6-(3-methylbutylamino)-5-nitro-1H-pyrimidin-4-one IUPAC Name: 6-(3-methylbutylamino)-5-nitro-1H-pyrimidin-4-one Traditional Name: 6-(isoamylamino)-5-nitro-1H-pyrimidin-4-one Formula: C9H14N4O3 MolecularWeight: 226.23246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=C(C(=O)N=CN1)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCNC1=C(C(=O)N=CN1)[N+](=O)[O-]

InChI

InChI=1S/C9H14N4O3/c1-6(2)3-4-10-8-7(13(15)16)9(14)12-5-11-8/h5-6H,3-4H2,1-2H3,(H2,10,11,12,14)