4-acetamido-3-[2-azanyl-4-(1-benzofuran-3-yl)imidazol-1-yl]benzoic acid

Systemtic Name: 4-acetamido-3-[2-azanyl-4-(1-benzofuran-3-yl)imidazol-1-yl]benzoic acid Openeye Name: 4-acetamido-3-[2-amino-4-(benzofuran-3-yl)imidazol-1-yl]benzoic acid CAS Name: 4-acetamido-3-[2-amino-4-(3-benzofuranyl)-1-imidazolyl]benzoic acid IUPAC Name: 4-acetamido-3-[2-amino-4-(1-benzofuran-3-yl)imidazol-1-yl]benzoic acid Traditional Name: 4-acetamido-3-[2-amino-4-(benzofuran-3-yl)imidazol-1-yl]benzoic acid Formula: C20H16N4O4 MolecularWeight: 376.36544

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)C(=O)O)N2C=C(N=C2N)C3=COC4=CC=CC=C43

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)C(=O)O)N2C=C(N=C2N)C3=COC4=CC=CC=C43

InChI

InChI=1S/C20H16N4O4/c1-11(25)22-15-7-6-12(19(26)27)8-17(15)24-9-16(23-20(24)21)14-10-28-18-5-3-2-4-13(14)18/h2-10H,1H3,(H2,21,23)(H,22,25)(H,26,27)