1-[2-(4-nitrophenyl)ethyl]-6-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 1-[2-(4-nitrophenyl)ethyl]-6-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-[2-(4-nitrophenyl)ethyl]-6-oxo-pyridine-3-carboxylic acid CAS Name: 1-[2-(4-nitrophenyl)ethyl]-6-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-[2-(4-nitrophenyl)ethyl]-6-oxopyridine-3-carboxylic acid Traditional Name: 6-keto-1-[2-(4-nitrophenyl)ethyl]nicotinic acid Formula: C14H12N2O5 MolecularWeight: 288.25548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCN2C=C(C=CC2=O)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CCN2C=C(C=CC2=O)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O5/c17-13-6-3-11(14(18)19)9-15(13)8-7-10-1-4-12(5-2-10)16(20)21/h1-6,9H,7-8H2,(H,18,19)