2-[(E)-2-[1-[(2-fluorophenyl)methyl]indol-3-yl]ethenyl]-5-nitro-6-oxidanylidene-1H-pyrimidin-4-olate

Systemtic Name: 2-[(E)-2-[1-[(2-fluorophenyl)methyl]indol-3-yl]ethenyl]-5-nitro-6-oxidanylidene-1H-pyrimidin-4-olate Openeye Name: 2-[(E)-2-[1-[(2-fluorophenyl)methyl]indol-3-yl]vinyl]-5-nitro-6-oxo-1H-pyrimidin-4-olate CAS Name: 2-[(E)-2-[1-[(2-fluorophenyl)methyl]-3-indolyl]ethenyl]-5-nitro-6-oxo-1H-pyrimidin-4-olate IUPAC Name: 2-[(E)-2-[1-[(2-fluorophenyl)methyl]indol-3-yl]ethenyl]-5-nitro-6-oxo-1H-pyrimidin-4-olate Traditional Name: 2-[(E)-2-[1-(2-fluorobenzyl)indol-3-yl]vinyl]-6-keto-5-nitro-1H-pyrimidin-4-olate Formula: C21H14FN4O4- MolecularWeight: 405.358663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=C(C3=CC=CC=C32)C=CC4=NC(=C(C(=O)N4)[N+](=O)[O-])[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=C(C3=CC=CC=C32)/C=C/C4=NC(=C(C(=O)N4)[N+](=O)[O-])[O-])F

InChI

InChI=1S/C21H15FN4O4/c22-16-7-3-1-5-14(16)12-25-11-13(15-6-2-4-8-17(15)25)9-10-18-23-20(27)19(26(29)30)21(28)24-18/h1-11H,12H2,(H2,23,24,27,28)/p-1/b10-9+