2-acetamido-3-(1H-pyrrolo[2,3-b]pyridin-3-yl)propanoic acid

Systemtic Name: 2-acetamido-3-(1H-pyrrolo[2,3-b]pyridin-3-yl)propanoic acid Openeye Name: 2-acetamido-3-(1H-pyrrolo[2,3-b]pyridin-3-yl)propanoic acid CAS Name: 2-acetamido-3-(1H-pyrrolo[2,3-b]pyridin-3-yl)propanoic acid IUPAC Name: 2-acetamido-3-(1H-pyrrolo[2,3-b]pyridin-3-yl)propanoic acid Traditional Name: 2-acetamido-3-(1H-pyrrolo[2,3-b]pyridin-3-yl)propionic acid Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CNC2=C1C=CC=N2)C(=O)O

Isomeric SMILES

CC(=O)NC(CC1=CNC2=C1C=CC=N2)C(=O)O

InChI

InChI=1S/C12H13N3O3/c1-7(16)15-10(12(17)18)5-8-6-14-11-9(8)3-2-4-13-11/h2-4,6,10H,5H2,1H3,(H,13,14)(H,15,16)(H,17,18)