2-methyl-5-[(4-nitrophenyl)methyl]-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-methyl-5-[(4-nitrophenyl)methyl]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-methyl-5-[(4-nitrophenyl)methyl]-6-propyl-1H-pyrimidin-4-one CAS Name: 2-methyl-5-[(4-nitrophenyl)methyl]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-methyl-5-[(4-nitrophenyl)methyl]-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-methyl-5-(4-nitrobenzyl)-6-propyl-1H-pyrimidin-4-one Formula: C15H17N3O3 MolecularWeight: 287.31378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)N=C(N1)C)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCC1=C(C(=O)N=C(N1)C)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O3/c1-3-4-14-13(15(19)17-10(2)16-14)9-11-5-7-12(8-6-11)18(20)21/h5-8H,3-4,9H2,1-2H3,(H,16,17,19)