5-[(2-methoxy-5-nitro-phenyl)methyl]-2-[(4-methoxyphenyl)amino]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 5-[(2-methoxy-5-nitro-phenyl)methyl]-2-[(4-methoxyphenyl)amino]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-(4-methoxyanilino)-5-[(2-methoxy-5-nitro-phenyl)methyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-(4-methoxyanilino)-5-[(2-methoxy-5-nitrophenyl)methyl]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-(4-methoxyanilino)-5-[(2-methoxy-5-nitrophenyl)methyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 5-(2-methoxy-5-nitro-benzyl)-6-methyl-2-(p-anisidino)-1H-pyrimidin-4-one Formula: C20H20N4O5 MolecularWeight: 396.3966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)NC2=CC=C(C=C2)OC)CC3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=C(C(=O)N=C(N1)NC2=CC=C(C=C2)OC)CC3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H20N4O5/c1-12-17(11-13-10-15(24(26)27)6-9-18(13)29-3)19(25)23-20(21-12)22-14-4-7-16(28-2)8-5-14/h4-10H,11H2,1-3H3,(H2,21,22,23,25)