2-azanyl-3-[2-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-1H-imidazol-5-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[2-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-1H-imidazol-5-yl]propanoic acid Openeye Name: 2-amino-3-[2-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-1H-imidazol-5-yl]propanoic acid CAS Name: 2-amino-3-[2-[6-(4-carbamimidoylphenyl)-3-pyridazinyl]-1H-imidazol-5-yl]propanoic acid IUPAC Name: 2-amino-3-[2-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-1H-imidazol-5-yl]propanoic acid Traditional Name: 3-[2-[6-(4-amidinophenyl)pyridazin-3-yl]-1H-imidazol-5-yl]-2-amino-propionic acid Formula: C17H17N7O2 MolecularWeight: 351.36258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN=C(C=C2)C3=NC=C(N3)CC(C(=O)O)N)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1C2=NN=C(C=C2)C3=NC=C(N3)CC(C(=O)O)N)C(=N)N

InChI

InChI=1S/C17H17N7O2/c18-12(17(25)26)7-11-8-21-16(22-11)14-6-5-13(23-24-14)9-1-3-10(4-2-9)15(19)20/h1-6,8,12H,7,18H2,(H3,19,20)(H,21,22)(H,25,26)