2-(3H-isoindol-2-ium-1-ylamino)ethanoate

Systemtic Name: 2-(3H-isoindol-2-ium-1-ylamino)ethanoate Openeye Name: 2-(3H-isoindol-2-ium-1-ylamino)acetate CAS Name: 2-(3H-isoindol-2-ium-1-ylamino)acetate IUPAC Name: 2-(3H-isoindol-2-ium-1-ylamino)acetate Traditional Name: 2-(3H-isoindol-2-ium-1-ylamino)acetate Formula: C10H10N2O2 MolecularWeight: 190.1986

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=[NH+]1)NCC(=O)[O-]

Isomeric SMILES

C1C2=CC=CC=C2C(=[NH+]1)NCC(=O)[O-]

InChI

InChI=1S/C10H10N2O2/c13-9(14)6-12-10-8-4-2-1-3-7(8)5-11-10/h1-4H,5-6H2,(H,11,12)(H,13,14)