2-(1-benzofuran-2-ylcarbonylamino)-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: 2-(1-benzofuran-2-ylcarbonylamino)-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: 2-(benzofuran-2-carbonylamino)-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 2-[[2-benzofuranyl(oxo)methyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 2-(1-benzofuran-2-carbonylamino)-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 2-(benzofuran-2-carbonylamino)-3-(1H-imidazol-5-yl)propionic acid Formula: C15H13N3O4 MolecularWeight: 299.28142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)NC(CC3=CN=CN3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)NC(CC3=CN=CN3)C(=O)O

InChI

InChI=1S/C15H13N3O4/c19-14(13-5-9-3-1-2-4-12(9)22-13)18-11(15(20)21)6-10-7-16-8-17-10/h1-5,7-8,11H,6H2,(H,16,17)(H,18,19)(H,20,21)