1-[(3-cyanophenyl)methyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: 1-[(3-cyanophenyl)methyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: 1-[(3-cyanophenyl)methyl]-6-oxo-pyridine-3-carboxylate CAS Name: 1-[(3-cyanophenyl)methyl]-6-oxo-3-pyridinecarboxylate IUPAC Name: 1-[(3-cyanophenyl)methyl]-6-oxopyridine-3-carboxylate Traditional Name: 1-(3-cyanobenzyl)-6-keto-nicotinate Formula: C14H9N2O3- MolecularWeight: 253.23286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2C=C(C=CC2=O)C(=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)CN2C=C(C=CC2=O)C(=O)[O-])C#N

InChI

InChI=1S/C14H10N2O3/c15-7-10-2-1-3-11(6-10)8-16-9-12(14(18)19)4-5-13(16)17/h1-6,9H,8H2,(H,18,19)/p-1