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

Systemtic Name: 5-nitro-2-[(E)-2-[3-(2-phenoxyethoxy)phenyl]ethenyl]-1H-pyrimidine-4,6-dione Openeye Name: 5-nitro-2-[(E)-2-[3-(2-phenoxyethoxy)phenyl]vinyl]-1H-pyrimidine-4,6-dione CAS Name: 5-nitro-2-[(E)-2-[3-(2-phenoxyethoxy)phenyl]ethenyl]-1H-pyrimidine-4,6-dione IUPAC Name: 5-nitro-2-[(E)-2-[3-(2-phenoxyethoxy)phenyl]ethenyl]-1H-pyrimidine-4,6-dione Traditional Name: 5-nitro-2-[(E)-2-[3-(2-phenoxyethoxy)phenyl]vinyl]-1H-pyrimidine-4,6-quinone Formula: C20H17N3O6 MolecularWeight: 395.36548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCOC2=CC=CC(=C2)C=CC3=NC(=O)C(C(=O)N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCCOC2=CC=CC(=C2)/C=C/C3=NC(=O)C(C(=O)N3)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O6/c24-19-18(23(26)27)20(25)22-17(21-19)10-9-14-5-4-8-16(13-14)29-12-11-28-15-6-2-1-3-7-15/h1-10,13,18H,11-12H2,(H,21,22,24,25)/b10-9+