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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC2=CC=C(C=C2)Cl)C(=N)N

Isomeric SMILES

C1CN(CCC1C(=O)OC2=CC=C(C=C2)Cl)C(=N)N

InChI

InChI=1S/C13H16ClN3O2/c14-10-1-3-11(4-2-10)19-12(18)9-5-7-17(8-6-9)13(15)16/h1-4,9H,5-8H2,(H3,15,16)