4-[1-(3-carbamimidoylphenyl)-1,2,3-triazol-4-yl]-3-methoxy-benzenecarboximidamide hydrochloride

Systemtic Name: 4-[1-(3-carbamimidoylphenyl)-1,2,3-triazol-4-yl]-3-methoxy-benzenecarboximidamide hydrochloride Openeye Name: 4-[1-(3-carbamimidoylphenyl)triazol-4-yl]-3-methoxy-benzamidine hydrochloride CAS Name: 4-[1-(3-carbamimidoylphenyl)-4-triazolyl]-3-methoxybenzenecarboximidamide hydrochloride IUPAC Name: 4-[1-(3-carbamimidoylphenyl)triazol-4-yl]-3-methoxybenzenecarboximidamide hydrochloride Traditional Name: 4-[1-(3-amidinophenyl)triazol-4-yl]-3-methoxy-benzamidine hydrochloride Formula: C17H18ClN7O MolecularWeight: 371.82412

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=N)N)C2=CN(N=N2)C3=CC=CC(=C3)C(=N)N.Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C(=N)N)C2=CN(N=N2)C3=CC=CC(=C3)C(=N)N.Cl

InChI

InChI=1S/C17H17N7O.ClH/c1-25-15-8-11(17(20)21)5-6-13(15)14-9-24(23-22-14)12-4-2-3-10(7-12)16(18)19;/h2-9H,1H3,(H3,18,19)(H3,20,21);1H