2-[[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]phenyl]-ethanoyl-amino]ethanoic acid

Systemtic Name: 2-[[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]phenyl]-ethanoyl-amino]ethanoic acid Openeye Name: 2-[N-acetyl-4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]anilino]acetic acid CAS Name: 2-[N-acetyl-4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]anilino]acetic acid IUPAC Name: 2-[N-acetyl-4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]anilino]acetic acid Traditional Name: 2-[N-acetyl-4-[5-(4-amidinophenyl)-1H-imidazol-2-yl]anilino]acetic acid Formula: C20H19N5O3 MolecularWeight: 377.39656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N5O3/c1-12(26)25(11-18(27)28)16-8-6-15(7-9-16)20-23-10-17(24-20)13-2-4-14(5-3-13)19(21)22/h2-10H,11H2,1H3,(H3,21,22)(H,23,24)(H,27,28)