(3S)-1-(4-nitrophenyl)piperidine-3-carboxylic acid

Systemtic Name: (3S)-1-(4-nitrophenyl)piperidine-3-carboxylic acid Openeye Name: (3S)-1-(4-nitrophenyl)piperidine-3-carboxylic acid CAS Name: (3S)-1-(4-nitrophenyl)-3-piperidinecarboxylic acid IUPAC Name: (3S)-1-(4-nitrophenyl)piperidine-3-carboxylic acid Traditional Name: (3S)-1-(4-nitrophenyl)nipecotic acid Formula: C12H14N2O4 MolecularWeight: 250.25056

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1C[C@@H](CN(C1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C12H14N2O4/c15-12(16)9-2-1-7-13(8-9)10-3-5-11(6-4-10)14(17)18/h3-6,9H,1-2,7-8H2,(H,15,16)/t9-/m0/s1