3-[(3-ethoxy-5-nitro-4-propan-2-yloxy-phenyl)methylideneamino]-1H-quinazoline-2,4-dione

Systemtic Name: 3-[(3-ethoxy-5-nitro-4-propan-2-yloxy-phenyl)methylideneamino]-1H-quinazoline-2,4-dione Openeye Name: 3-[(3-ethoxy-4-isopropoxy-5-nitro-phenyl)methyleneamino]-1H-quinazoline-2,4-dione CAS Name: 3-[(3-ethoxy-5-nitro-4-propan-2-yloxyphenyl)methylideneamino]-1H-quinazoline-2,4-dione IUPAC Name: 3-[(3-ethoxy-5-nitro-4-propan-2-yloxyphenyl)methylideneamino]-1H-quinazoline-2,4-dione Traditional Name: 3-[(3-ethoxy-4-isopropoxy-5-nitro-benzylidene)amino]-1H-quinazoline-2,4-quinone Formula: C20H20N4O6 MolecularWeight: 412.396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OC(C)C)[N+](=O)[O-])C=NN2C(=O)C3=CC=CC=C3NC2=O

Isomeric SMILES

CCOC1=CC(=CC(=C1OC(C)C)[N+](=O)[O-])C=NN2C(=O)C3=CC=CC=C3NC2=O

InChI

InChI=1S/C20H20N4O6/c1-4-29-17-10-13(9-16(24(27)28)18(17)30-12(2)3)11-21-23-19(25)14-7-5-6-8-15(14)22-20(23)26/h5-12H,4H2,1-3H3,(H,22,26)