methyl 2-[1-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]piperidin-4-yl]ethanoate hydrochloride

Systemtic Name: methyl 2-[1-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]piperidin-4-yl]ethanoate hydrochloride Openeye Name: methyl 2-[1-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-4-piperidyl]acetate hydrochloride CAS Name: 2-[1-[6-(4-carbamimidoylphenyl)-3-pyridazinyl]-4-piperidinyl]acetic acid methyl ester hydrochloride IUPAC Name: methyl 2-[1-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]piperidin-4-yl]acetate hydrochloride Traditional Name: 2-[1-[6-(4-amidinophenyl)pyridazin-3-yl]-4-piperidyl]acetic acid methyl ester hydrochloride Formula: C19H24ClN5O2 MolecularWeight: 389.87916

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N.Cl

Isomeric SMILES

COC(=O)CC1CCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N.Cl

InChI

InChI=1S/C19H23N5O2.ClH/c1-26-18(25)12-13-8-10-24(11-9-13)17-7-6-16(22-23-17)14-2-4-15(5-3-14)19(20)21;/h2-7,13H,8-12H2,1H3,(H3,20,21);1H