2-[1-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]piperidin-3-yl]oxyethanoic acid

Systemtic Name: 2-[1-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]piperidin-3-yl]oxyethanoic acid Openeye Name: 2-[[1-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]-3-piperidyl]oxy]acetic acid CAS Name: 2-[[1-[6-(4-carbamimidoylphenyl)-3-pyridazinyl]-3-piperidinyl]oxy]acetic acid IUPAC Name: 2-[1-[6-(4-carbamimidoylphenyl)pyridazin-3-yl]piperidin-3-yl]oxyacetic acid Traditional Name: 2-[[1-[6-(4-amidinophenyl)pyridazin-3-yl]-3-piperidyl]oxy]acetic acid Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N)OCC(=O)O

Isomeric SMILES

C1CC(CN(C1)C2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N)OCC(=O)O

InChI

InChI=1S/C18H21N5O3/c19-18(20)13-5-3-12(4-6-13)15-7-8-16(22-21-15)23-9-1-2-14(10-23)26-11-17(24)25/h3-8,14H,1-2,9-11H2,(H3,19,20)(H,24,25)