5-nitro-4-oxidanylidene-6-[2-(1-propan-2-ylindol-3-yl)ethenyl]-1H-pyrimidin-2-olate

Systemtic Name: 5-nitro-4-oxidanylidene-6-[2-(1-propan-2-ylindol-3-yl)ethenyl]-1H-pyrimidin-2-olate Openeye Name: 6-[2-(1-isopropylindol-3-yl)vinyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate CAS Name: 5-nitro-4-oxo-6-[2-(1-propan-2-yl-3-indolyl)ethenyl]-1H-pyrimidin-2-olate IUPAC Name: 5-nitro-4-oxo-6-[2-(1-propan-2-ylindol-3-yl)ethenyl]-1H-pyrimidin-2-olate Traditional Name: 6-[2-(1-isopropylindol-3-yl)vinyl]-4-keto-5-nitro-1H-pyrimidin-2-olate Formula: C17H15N4O4- MolecularWeight: 339.3254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C2=CC=CC=C21)C=CC3=C(C(=O)N=C(N3)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C=C(C2=CC=CC=C21)C=CC3=C(C(=O)N=C(N3)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O4/c1-10(2)20-9-11(12-5-3-4-6-14(12)20)7-8-13-15(21(24)25)16(22)19-17(23)18-13/h3-10H,1-2H3,(H2,18,19,22,23)/p-1