6-[(E)-2-[3-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione

Systemtic Name: 6-[(E)-2-[3-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione Openeye Name: 6-[(E)-2-[3-ethoxy-4-(m-tolylmethoxy)phenyl]vinyl]-5-nitro-1H-pyrimidine-2,4-dione CAS Name: 6-[(E)-2-[3-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione IUPAC Name: 6-[(E)-2-[3-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione Traditional Name: 6-[(E)-2-[3-ethoxy-4-(3-methylbenzyl)oxy-phenyl]vinyl]-5-nitro-uracil Formula: C22H21N3O6 MolecularWeight: 423.41864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC2=C(C(=O)NC(=O)N2)[N+](=O)[O-])OCC3=CC=CC(=C3)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C2=C(C(=O)NC(=O)N2)[N+](=O)[O-])OCC3=CC=CC(=C3)C

InChI

InChI=1S/C22H21N3O6/c1-3-30-19-12-15(7-9-17-20(25(28)29)21(26)24-22(27)23-17)8-10-18(19)31-13-16-6-4-5-14(2)11-16/h4-12H,3,13H2,1-2H3,(H2,23,24,26,27)/b9-7+