[6-(4-carbamimidoylphenyl)pyridazin-3-yl]oxy-[2-(1H-imidazol-5-yl)ethyl]phosphinic acid

Systemtic Name: [6-(4-carbamimidoylphenyl)pyridazin-3-yl]oxy-[2-(1H-imidazol-5-yl)ethyl]phosphinic acid Openeye Name: [6-(4-carbamimidoylphenyl)pyridazin-3-yl]oxy-[2-(1H-imidazol-5-yl)ethyl]phosphinic acid CAS Name: [6-(4-carbamimidoylphenyl)-3-pyridazinyl]oxy-[2-(1H-imidazol-5-yl)ethyl]phosphinic acid IUPAC Name: [6-(4-carbamimidoylphenyl)pyridazin-3-yl]oxy-[2-(1H-imidazol-5-yl)ethyl]phosphinic acid Traditional Name: [6-(4-amidinophenyl)pyridazin-3-yl]oxy-[2-(1H-imidazol-5-yl)ethyl]phosphinic acid Formula: C16H17N6O3P MolecularWeight: 372.318341

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN=C(C=C2)OP(=O)(CCC3=CN=CN3)O)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1C2=NN=C(C=C2)OP(=O)(CCC3=CN=CN3)O)C(=N)N

InChI

InChI=1S/C16H17N6O3P/c17-16(18)12-3-1-11(2-4-12)14-5-6-15(22-21-14)25-26(23,24)8-7-13-9-19-10-20-13/h1-6,9-10H,7-8H2,(H3,17,18)(H,19,20)(H,23,24)