methyl 3-[1-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]imidazol-4-yl]-2-oxidanyl-propanoate hydrochloride

Systemtic Name: methyl 3-[1-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]imidazol-4-yl]-2-oxidanyl-propanoate hydrochloride Openeye Name: methyl 3-[1-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]imidazol-4-yl]-2-hydroxy-propanoate hydrochloride CAS Name: 3-[1-[6-(4-carbamimidoylphenyl)-3-pyridazinyl]-4-imidazolyl]-2-hydroxypropanoic acid methyl ester hydrochloride IUPAC Name: methyl 3-[1-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]imidazol-4-yl]-2-hydroxypropanoate hydrochloride Traditional Name: 3-[1-[6-(4-amidinophenyl)pyridazin-3-yl]imidazol-4-yl]-2-hydroxy-propionic acid methyl ester hydrochloride Formula: C18H19ClN6O3 MolecularWeight: 402.83486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CN(C=N1)C2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N)O.Cl

Isomeric SMILES

COC(=O)C(CC1=CN(C=N1)C2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N)O.Cl

InChI

InChI=1S/C18H18N6O3.ClH/c1-27-18(26)15(25)8-13-9-24(10-21-13)16-7-6-14(22-23-16)11-2-4-12(5-3-11)17(19)20;/h2-7,9-10,15,25H,8H2,1H3,(H3,19,20);1H