2-[3-(1H-benzimidazol-2-yl)propanoylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[3-(1H-benzimidazol-2-yl)propanoylamino]-3-oxidanyl-propanoic acid Openeye Name: 2-[3-(1H-benzimidazol-2-yl)propanoylamino]-3-hydroxy-propanoic acid CAS Name: 2-[[3-(1H-benzimidazol-2-yl)-1-oxopropyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[3-(1H-benzimidazol-2-yl)propanoylamino]-3-hydroxypropanoic acid Traditional Name: 2-[3-(1H-benzimidazol-2-yl)propanoylamino]-3-hydroxy-propionic acid Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CCC(=O)NC(CO)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CCC(=O)NC(CO)C(=O)O

InChI

InChI=1S/C13H15N3O4/c17-7-10(13(19)20)16-12(18)6-5-11-14-8-3-1-2-4-9(8)15-11/h1-4,10,17H,5-7H2,(H,14,15)(H,16,18)(H,19,20)