sodium 6-oxidanylidene-1-phenyl-piperidine-3-carboxylate

Systemtic Name: sodium 6-oxidanylidene-1-phenyl-piperidine-3-carboxylate Openeye Name: sodium 6-oxo-1-phenyl-piperidine-3-carboxylate CAS Name: sodium 6-oxo-1-phenyl-3-piperidinecarboxylate IUPAC Name: sodium 6-oxo-1-phenylpiperidine-3-carboxylate Traditional Name: sodium 6-keto-1-phenyl-nipecotate Formula: C12H12NNaO3 MolecularWeight: 241.21835

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CC1C(=O)[O-])C2=CC=CC=C2.[Na+]

Isomeric SMILES

C1CC(=O)N(CC1C(=O)[O-])C2=CC=CC=C2.[Na+]

InChI

InChI=1S/C12H13NO3.Na/c14-11-7-6-9(12(15)16)8-13(11)10-4-2-1-3-5-10;/h1-5,9H,6-8H2,(H,15,16);/q;+1/p-1