2-acetamido-5-nitro-6-[(E)-2-phenylethenyl]pyrimidin-4-olate

Systemtic Name: 2-acetamido-5-nitro-6-[(E)-2-phenylethenyl]pyrimidin-4-olate Openeye Name: 2-acetamido-5-nitro-6-[(E)-styryl]pyrimidin-4-olate CAS Name: 2-acetamido-5-nitro-6-[(E)-2-phenylethenyl]-4-pyrimidinolate IUPAC Name: 2-acetamido-5-nitro-6-[(E)-2-phenylethenyl]pyrimidin-4-olate Traditional Name: 2-acetamido-5-nitro-6-[(E)-styryl]pyrimidin-4-olate Formula: C14H11N4O4- MolecularWeight: 299.26154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=C(C(=N1)[O-])[N+](=O)[O-])C=CC2=CC=CC=C2

Isomeric SMILES

CC(=O)NC1=NC(=C(C(=N1)[O-])[N+](=O)[O-])/C=C/C2=CC=CC=C2

InChI

InChI=1S/C14H12N4O4/c1-9(19)15-14-16-11(12(18(21)22)13(20)17-14)8-7-10-5-3-2-4-6-10/h2-8H,1H3,(H2,15,16,17,19,20)/p-1/b8-7+