5-nitro-2-(2-propoxyphenyl)-1H-pyrimidin-6-one

Systemtic Name: 5-nitro-2-(2-propoxyphenyl)-1H-pyrimidin-6-one Openeye Name: 5-nitro-2-(2-propoxyphenyl)-1H-pyrimidin-6-one CAS Name: 5-nitro-2-(2-propoxyphenyl)-1H-pyrimidin-6-one IUPAC Name: 5-nitro-2-(2-propoxyphenyl)-1H-pyrimidin-6-one Traditional Name: 5-nitro-2-(2-propoxyphenyl)-1H-pyrimidin-6-one Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2=NC=C(C(=O)N2)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=CC=CC=C1C2=NC=C(C(=O)N2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O4/c1-2-7-20-11-6-4-3-5-9(11)12-14-8-10(16(18)19)13(17)15-12/h3-6,8H,2,7H2,1H3,(H,14,15,17)