3-[1-[5-(4-carbamimidoylphenyl)pyridin-2-yl]imidazol-4-yl]propanoic acid

Systemtic Name: 3-[1-[5-(4-carbamimidoylphenyl)pyridin-2-yl]imidazol-4-yl]propanoic acid Openeye Name: 3-[1-[5-(4-carbamimidoylphenyl)-2-pyridyl]imidazol-4-yl]propanoic acid CAS Name: 3-[1-[5-(4-carbamimidoylphenyl)-2-pyridinyl]-4-imidazolyl]propanoic acid IUPAC Name: 3-[1-[5-(4-carbamimidoylphenyl)pyridin-2-yl]imidazol-4-yl]propanoic acid Traditional Name: 3-[1-[5-(4-amidinophenyl)-2-pyridyl]imidazol-4-yl]propionic acid Formula: C18H17N5O2 MolecularWeight: 335.35988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CN=C(C=C2)N3C=C(N=C3)CCC(=O)O)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1C2=CN=C(C=C2)N3C=C(N=C3)CCC(=O)O)C(=N)N

InChI

InChI=1S/C18H17N5O2/c19-18(20)13-3-1-12(2-4-13)14-5-7-16(21-9-14)23-10-15(22-11-23)6-8-17(24)25/h1-5,7,9-11H,6,8H2,(H3,19,20)(H,24,25)