5-[6-(4-carbamimidoylphenyl)-3-(methylamino)-1H-pyridazin-2-yl]pentanoic acid

Systemtic Name: 5-[6-(4-carbamimidoylphenyl)-3-(methylamino)-1H-pyridazin-2-yl]pentanoic acid Openeye Name: 5-[6-(4-carbamimidoylphenyl)-3-(methylamino)-1H-pyridazin-2-yl]pentanoic acid CAS Name: 5-[6-(4-carbamimidoylphenyl)-3-(methylamino)-1H-pyridazin-2-yl]pentanoic acid IUPAC Name: 5-[6-(4-carbamimidoylphenyl)-3-(methylamino)-1H-pyridazin-2-yl]pentanoic acid Traditional Name: 5-[6-(4-amidinophenyl)-3-(methylamino)-1H-pyridazin-2-yl]valeric acid Formula: C17H23N5O2 MolecularWeight: 329.39682

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=C(NN1CCCCC(=O)O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CNC1=CC=C(NN1CCCCC(=O)O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C17H23N5O2/c1-20-15-10-9-14(12-5-7-13(8-6-12)17(18)19)21-22(15)11-3-2-4-16(23)24/h5-10,20-21H,2-4,11H2,1H3,(H3,18,19)(H,23,24)