6-oxidanylidene-1-phenethyl-pyridine-3-carboxylate

Systemtic Name: 6-oxidanylidene-1-phenethyl-pyridine-3-carboxylate Openeye Name: 6-oxo-1-phenethyl-pyridine-3-carboxylate CAS Name: 6-oxo-1-phenethyl-3-pyridinecarboxylate IUPAC Name: 6-oxo-1-phenethylpyridine-3-carboxylate Traditional Name: 6-keto-1-phenethyl-nicotinate Formula: C14H12NO3- MolecularWeight: 242.24998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C=C(C=CC2=O)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCN2C=C(C=CC2=O)C(=O)[O-]

InChI

InChI=1S/C14H13NO3/c16-13-7-6-12(14(17)18)10-15(13)9-8-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H,17,18)/p-1