1-(5-chloranyl-2-nitro-phenyl)piperidine-4-carboxylate

Systemtic Name: 1-(5-chloranyl-2-nitro-phenyl)piperidine-4-carboxylate Openeye Name: 1-(5-chloro-2-nitro-phenyl)piperidine-4-carboxylate CAS Name: 1-(5-chloro-2-nitrophenyl)-4-piperidinecarboxylate IUPAC Name: 1-(5-chloro-2-nitrophenyl)piperidine-4-carboxylate Traditional Name: 1-(5-chloro-2-nitro-phenyl)isonipecotate Formula: C12H12ClN2O4- MolecularWeight: 283.68768

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)[O-])C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)[O-])C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H13ClN2O4/c13-9-1-2-10(15(18)19)11(7-9)14-5-3-8(4-6-14)12(16)17/h1-2,7-8H,3-6H2,(H,16,17)/p-1