3-[4-[[6-(4-carbamimidoylphenyl)pyridazin-3-yl]amino]phenyl]propanoic acid

Systemtic Name: 3-[4-[[6-(4-carbamimidoylphenyl)pyridazin-3-yl]amino]phenyl]propanoic acid Openeye Name: 3-[4-[[6-(4-carbamimidoylphenyl)pyridazin-3-yl]amino]phenyl]propanoic acid CAS Name: 3-[4-[[6-(4-carbamimidoylphenyl)-3-pyridazinyl]amino]phenyl]propanoic acid IUPAC Name: 3-[4-[[6-(4-carbamimidoylphenyl)pyridazin-3-yl]amino]phenyl]propanoic acid Traditional Name: 3-[4-[[6-(4-amidinophenyl)pyridazin-3-yl]amino]phenyl]propionic acid Formula: C20H19N5O2 MolecularWeight: 361.39716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)NC2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)NC2=NN=C(C=C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H19N5O2/c21-20(22)15-6-4-14(5-7-15)17-10-11-18(25-24-17)23-16-8-1-13(2-9-16)3-12-19(26)27/h1-2,4-11H,3,12H2,(H3,21,22)(H,23,25)(H,26,27)