2-[(E)-2-naphthalen-1-ylethenyl]-5-nitro-6-oxidanylidene-1H-pyrimidin-4-olate

Systemtic Name: 2-[(E)-2-naphthalen-1-ylethenyl]-5-nitro-6-oxidanylidene-1H-pyrimidin-4-olate Openeye Name: 2-[(E)-2-(1-naphthyl)vinyl]-5-nitro-6-oxo-1H-pyrimidin-4-olate CAS Name: 2-[(E)-2-(1-naphthalenyl)ethenyl]-5-nitro-6-oxo-1H-pyrimidin-4-olate IUPAC Name: 2-[(E)-2-naphthalen-1-ylethenyl]-5-nitro-6-oxo-1H-pyrimidin-4-olate Traditional Name: 6-keto-2-[(E)-2-(1-naphthyl)vinyl]-5-nitro-1H-pyrimidin-4-olate Formula: C16H10N3O4- MolecularWeight: 308.2683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C=CC3=NC(=C(C(=O)N3)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2/C=C/C3=NC(=C(C(=O)N3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C16H11N3O4/c20-15-14(19(22)23)16(21)18-13(17-15)9-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-9H,(H2,17,18,20,21)/p-1/b9-8+