6-[(2-methylquinolin-8-yl)amino]-5-nitro-1H-pyrimidin-4-one

Systemtic Name: 6-[(2-methylquinolin-8-yl)amino]-5-nitro-1H-pyrimidin-4-one Openeye Name: 6-[(2-methyl-8-quinolyl)amino]-5-nitro-1H-pyrimidin-4-one CAS Name: 6-[(2-methyl-8-quinolinyl)amino]-5-nitro-1H-pyrimidin-4-one IUPAC Name: 6-[(2-methylquinolin-8-yl)amino]-5-nitro-1H-pyrimidin-4-one Traditional Name: 6-[(2-methyl-8-quinolyl)amino]-5-nitro-1H-pyrimidin-4-one Formula: C14H11N5O3 MolecularWeight: 297.26884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC3=C(C(=O)N=CN3)[N+](=O)[O-])C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC3=C(C(=O)N=CN3)[N+](=O)[O-])C=C1

InChI

InChI=1S/C14H11N5O3/c1-8-5-6-9-3-2-4-10(11(9)17-8)18-13-12(19(21)22)14(20)16-7-15-13/h2-7H,1H3,(H2,15,16,18,20)