5-nitro-4-oxidanylidene-6-[(E)-2-(2-propan-2-yloxyphenyl)ethenyl]-1H-pyrimidin-2-olate

Systemtic Name: 5-nitro-4-oxidanylidene-6-[(E)-2-(2-propan-2-yloxyphenyl)ethenyl]-1H-pyrimidin-2-olate Openeye Name: 6-[(E)-2-(2-isopropoxyphenyl)vinyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate CAS Name: 5-nitro-4-oxo-6-[(E)-2-(2-propan-2-yloxyphenyl)ethenyl]-1H-pyrimidin-2-olate IUPAC Name: 5-nitro-4-oxo-6-[(E)-2-(2-propan-2-yloxyphenyl)ethenyl]-1H-pyrimidin-2-olate Traditional Name: 6-[(E)-2-(2-isopropoxyphenyl)vinyl]-4-keto-5-nitro-1H-pyrimidin-2-olate Formula: C15H14N3O5- MolecularWeight: 316.28876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1C=CC2=C(C(=O)N=C(N2)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=CC=C1/C=C/C2=C(C(=O)N=C(N2)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H15N3O5/c1-9(2)23-12-6-4-3-5-10(12)7-8-11-13(18(21)22)14(19)17-15(20)16-11/h3-9H,1-2H3,(H2,16,17,19,20)/p-1/b8-7+