3-[(1R)-1H-isoindol-2-ium-1-yl]propanoate

Systemtic Name: 3-[(1R)-1H-isoindol-2-ium-1-yl]propanoate Openeye Name: 3-[(1R)-1H-isoindol-2-ium-1-yl]propanoate CAS Name: 3-[(1R)-1H-isoindol-2-ium-1-yl]propanoate IUPAC Name: 3-[(1R)-1H-isoindol-2-ium-1-yl]propanoate Traditional Name: 3-[(1R)-1H-isoindol-2-ium-1-yl]propionate Formula: C11H11NO2 MolecularWeight: 189.21054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C([NH+]=CC2=C1)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C2[C@H]([NH+]=CC2=C1)CCC(=O)[O-]

InChI

InChI=1S/C11H11NO2/c13-11(14)6-5-10-9-4-2-1-3-8(9)7-12-10/h1-4,7,10H,5-6H2,(H,13,14)/t10-/m1/s1