3-[(E)-(4,5-dimethoxy-2-nitro-phenyl)methylideneamino]-2-propyl-quinazolin-4-one

Systemtic Name: 3-[(E)-(4,5-dimethoxy-2-nitro-phenyl)methylideneamino]-2-propyl-quinazolin-4-one Openeye Name: 3-[(E)-(4,5-dimethoxy-2-nitro-phenyl)methyleneamino]-2-propyl-quinazolin-4-one CAS Name: 3-[(E)-(4,5-dimethoxy-2-nitrophenyl)methylideneamino]-2-propyl-4-quinazolinone IUPAC Name: 3-[(E)-(4,5-dimethoxy-2-nitrophenyl)methylideneamino]-2-propylquinazolin-4-one Traditional Name: 3-[(E)-(4,5-dimethoxy-2-nitro-benzylidene)amino]-2-propyl-quinazolin-4-one Formula: C20H20N4O5 MolecularWeight: 396.3966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=O)N1N=CC3=CC(=C(C=C3[N+](=O)[O-])OC)OC

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=O)N1/N=C/C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

InChI

InChI=1S/C20H20N4O5/c1-4-7-19-22-15-9-6-5-8-14(15)20(25)23(19)21-12-13-10-17(28-2)18(29-3)11-16(13)24(26)27/h5-6,8-12H,4,7H2,1-3H3/b21-12+