3-[(7-carbamimidoylnaphthalen-2-yl)methyl]pyridine-2-carboxamide trihydrochloride

Systemtic Name: 3-[(7-carbamimidoylnaphthalen-2-yl)methyl]pyridine-2-carboxamide trihydrochloride Openeye Name: 3-[(7-carbamimidoyl-2-naphthyl)methyl]pyridine-2-carboxamide trihydrochloride CAS Name: 3-[(7-carbamimidoyl-2-naphthalenyl)methyl]-2-pyridinecarboxamide trihydrochloride IUPAC Name: 3-[(7-carbamimidoylnaphthalen-2-yl)methyl]pyridine-2-carboxamide trihydrochloride Traditional Name: 3-[(7-amidino-2-naphthyl)methyl]picolinamide trihydrochloride Formula: C18H19Cl3N4O MolecularWeight: 413.72866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)C(=O)N)CC2=CC3=C(C=C2)C=CC(=C3)C(=N)N.Cl.Cl.Cl

Isomeric SMILES

C1=CC(=C(N=C1)C(=O)N)CC2=CC3=C(C=C2)C=CC(=C3)C(=N)N.Cl.Cl.Cl

InChI

InChI=1S/C18H16N4O.3ClH/c19-17(20)14-6-5-12-4-3-11(9-15(12)10-14)8-13-2-1-7-22-16(13)18(21)23;;;/h1-7,9-10H,8H2,(H3,19,20)(H2,21,23);3*1H