2-(5-nitropyridin-2-yl)-2-phenyl-propanedioate

Systemtic Name: 2-(5-nitropyridin-2-yl)-2-phenyl-propanedioate Openeye Name: 2-(5-nitro-2-pyridyl)-2-phenyl-propanedioate CAS Name: 2-(5-nitro-2-pyridinyl)-2-phenylpropanedioate IUPAC Name: 2-(5-nitropyridin-2-yl)-2-phenylpropanedioate Traditional Name: 2-(5-nitro-2-pyridyl)-2-phenyl-malonate Formula: C14H8N2O6-2 MolecularWeight: 300.22312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=NC=C(C=C2)[N+](=O)[O-])(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=NC=C(C=C2)[N+](=O)[O-])(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C14H10N2O6/c17-12(18)14(13(19)20,9-4-2-1-3-5-9)11-7-6-10(8-15-11)16(21)22/h1-8H,(H,17,18)(H,19,20)/p-2