(2,4-dichlorophenyl) 1-carbamimidoylpiperidine-4-carboxylate hydrochloride

Systemtic Name: (2,4-dichlorophenyl) 1-carbamimidoylpiperidine-4-carboxylate hydrochloride Openeye Name: (2,4-dichlorophenyl) 1-carbamimidoylpiperidine-4-carboxylate hydrochloride CAS Name: 1-carbamimidoyl-4-piperidinecarboxylic acid (2,4-dichlorophenyl) ester hydrochloride IUPAC Name: (2,4-dichlorophenyl) 1-carbamimidoylpiperidine-4-carboxylate hydrochloride Traditional Name: 1-amidinoisonipecotic acid (2,4-dichlorophenyl) ester hydrochloride Formula: C13H16Cl3N3O2 MolecularWeight: 352.64404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15Cl2N3O2.ClH/c14-9-1-2-11(10(15)7-9)20-12(19)8-3-5-18(6-4-8)13(16)17;/h1-2,7-8H,3-6H2,(H3,16,17);1H