N-[(4-carbamimidoylphenyl)methyl]pyrrolidine-2-carboxamide dihydrochloride

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]pyrrolidine-2-carboxamide dihydrochloride Openeye Name: N-[(4-carbamimidoylphenyl)methyl]pyrrolidine-2-carboxamide dihydrochloride CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-pyrrolidinecarboxamide dihydrochloride IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]pyrrolidine-2-carboxamide dihydrochloride Traditional Name: N-(4-amidinobenzyl)pyrrolidine-2-carboxamide dihydrochloride Formula: C13H20Cl2N4O MolecularWeight: 319.2301

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)NCC2=CC=C(C=C2)C(=N)N.Cl.Cl

Isomeric SMILES

C1CC(NC1)C(=O)NCC2=CC=C(C=C2)C(=N)N.Cl.Cl

InChI

InChI=1S/C13H18N4O.2ClH/c14-12(15)10-5-3-9(4-6-10)8-17-13(18)11-2-1-7-16-11;;/h3-6,11,16H,1-2,7-8H2,(H3,14,15)(H,17,18);2*1H