2-[(1R)-2-oxidanylidenecyclohexyl]pyridine-4-carboxylate

Systemtic Name: 2-[(1R)-2-oxidanylidenecyclohexyl]pyridine-4-carboxylate Openeye Name: 2-[(1R)-2-oxocyclohexyl]pyridine-4-carboxylate CAS Name: 2-[(1R)-2-oxocyclohexyl]-4-pyridinecarboxylate IUPAC Name: 2-[(1R)-2-oxocyclohexyl]pyridine-4-carboxylate Traditional Name: 2-[(1R)-2-ketocyclohexyl]isonicotinate Formula: C12H12NO3- MolecularWeight: 218.22858

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)C2=NC=CC(=C2)C(=O)[O-]

Isomeric SMILES

C1CCC(=O)[C@H](C1)C2=NC=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C12H13NO3/c14-11-4-2-1-3-9(11)10-7-8(12(15)16)5-6-13-10/h5-7,9H,1-4H2,(H,15,16)/p-1/t9-/m1/s1