3-[5-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-2-oxidanylidene-imidazolidin-1-yl]propanoic acid

Systemtic Name: 3-[5-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-2-oxidanylidene-imidazolidin-1-yl]propanoic acid Openeye Name: 3-[5-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-2-oxo-imidazolidin-1-yl]propanoic acid CAS Name: 3-[5-[6-(4-carbamimidoylphenyl)-3-pyridazinyl]-2-oxo-1-imidazolidinyl]propanoic acid IUPAC Name: 3-[5-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-2-oxoimidazolidin-1-yl]propanoic acid Traditional Name: 3-[5-[6-(4-amidinophenyl)pyridazin-3-yl]-2-keto-imidazolidin-1-yl]propionic acid Formula: C17H18N6O3 MolecularWeight: 354.36322

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(=O)N1)CCC(=O)O)C2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1C(N(C(=O)N1)CCC(=O)O)C2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C17H18N6O3/c18-16(19)11-3-1-10(2-4-11)12-5-6-13(22-21-12)14-9-20-17(26)23(14)8-7-15(24)25/h1-6,14H,7-9H2,(H3,18,19)(H,20,26)(H,24,25)