(4-chlorophenyl) 1-carbamimidoylpiperidine-3-carboxylate

Systemtic Name: (4-chlorophenyl) 1-carbamimidoylpiperidine-3-carboxylate Openeye Name: (4-chlorophenyl) 1-carbamimidoylpiperidine-3-carboxylate CAS Name: 1-carbamimidoyl-3-piperidinecarboxylic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) 1-carbamimidoylpiperidine-3-carboxylate Traditional Name: 1-amidinonipecotic acid (4-chlorophenyl) ester Formula: C13H16ClN3O2 MolecularWeight: 281.73804

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=N)N)C(=O)OC2=CC=C(C=C2)Cl

Isomeric SMILES

C1CC(CN(C1)C(=N)N)C(=O)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H16ClN3O2/c14-10-3-5-11(6-4-10)19-12(18)9-2-1-7-17(8-9)13(15)16/h3-6,9H,1-2,7-8H2,(H3,15,16)