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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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