3-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]-2-methoxy-phenyl]propanoic acid

Systemtic Name: 3-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]-2-methoxy-phenyl]propanoic acid Openeye Name: 3-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]-2-methoxy-phenyl]propanoic acid CAS Name: 3-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]-2-methoxyphenyl]propanoic acid IUPAC Name: 3-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]-2-methoxyphenyl]propanoic acid Traditional Name: 3-[4-[5-(4-amidinophenyl)-1H-imidazol-2-yl]-2-methoxy-phenyl]propionic acid Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=NC=C(N2)C3=CC=C(C=C3)C(=N)N)CCC(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2=NC=C(N2)C3=CC=C(C=C3)C(=N)N)CCC(=O)O

InChI

InChI=1S/C20H20N4O3/c1-27-17-10-15(7-4-13(17)8-9-18(25)26)20-23-11-16(24-20)12-2-5-14(6-3-12)19(21)22/h2-7,10-11H,8-9H2,1H3,(H3,21,22)(H,23,24)(H,25,26)