2-nitro-5-(pyridin-3-ylmethylcarbamoyl)phenolate

Systemtic Name: 2-nitro-5-(pyridin-3-ylmethylcarbamoyl)phenolate Openeye Name: 2-nitro-5-(3-pyridylmethylcarbamoyl)phenolate CAS Name: 2-nitro-5-[oxo-(3-pyridinylmethylamino)methyl]phenolate IUPAC Name: 2-nitro-5-(pyridin-3-ylmethylcarbamoyl)phenolate Traditional Name: 2-nitro-5-(3-pyridylmethylcarbamoyl)phenolate Formula: C13H10N3O4- MolecularWeight: 272.2362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N3O4/c17-12-6-10(3-4-11(12)16(19)20)13(18)15-8-9-2-1-5-14-7-9/h1-7,17H,8H2,(H,15,18)/p-1