(2S)-2-(3H-benzimidazol-5-ylcarbonylamino)-3-oxidanyl-propanoic acid

Systemtic Name: (2S)-2-(3H-benzimidazol-5-ylcarbonylamino)-3-oxidanyl-propanoic acid Openeye Name: (2S)-2-(3H-benzimidazole-5-carbonylamino)-3-hydroxy-propanoic acid CAS Name: (2S)-2-[[3H-benzimidazol-5-yl(oxo)methyl]amino]-3-hydroxypropanoic acid IUPAC Name: (2S)-2-(3H-benzimidazole-5-carbonylamino)-3-hydroxypropanoic acid Traditional Name: (2S)-2-(3H-benzimidazole-5-carbonylamino)-3-hydroxy-propionic acid Formula: C11H11N3O4 MolecularWeight: 249.22274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)NC(CO)C(=O)O)NC=N2

Isomeric SMILES

C1=CC2=C(C=C1C(=O)N[C@@H](CO)C(=O)O)NC=N2

InChI

InChI=1S/C11H11N3O4/c15-4-9(11(17)18)14-10(16)6-1-2-7-8(3-6)13-5-12-7/h1-3,5,9,15H,4H2,(H,12,13)(H,14,16)(H,17,18)/t9-/m0/s1