methyl 3-[4-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]piperazin-1-yl]propanoate hydrochloride

Systemtic Name: methyl 3-[4-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]piperazin-1-yl]propanoate hydrochloride Openeye Name: methyl 3-[4-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]piperazin-1-yl]propanoate hydrochloride CAS Name: 3-[4-[6-(4-carbamimidoylphenyl)-3-pyridazinyl]-1-piperazinyl]propanoic acid methyl ester hydrochloride IUPAC Name: methyl 3-[4-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]piperazin-1-yl]propanoate hydrochloride Traditional Name: 3-[4-[6-(4-amidinophenyl)pyridazin-3-yl]piperazino]propionic acid methyl ester hydrochloride Formula: C19H25ClN6O2 MolecularWeight: 404.8938

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1CCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N.Cl

Isomeric SMILES

COC(=O)CCN1CCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N.Cl

InChI

InChI=1S/C19H24N6O2.ClH/c1-27-18(26)8-9-24-10-12-25(13-11-24)17-7-6-16(22-23-17)14-2-4-15(5-3-14)19(20)21;/h2-7H,8-13H2,1H3,(H3,20,21);1H