(2S)-2-(3H-isoindol-2-ium-1-ylamino)propanoate

Systemtic Name: (2S)-2-(3H-isoindol-2-ium-1-ylamino)propanoate Openeye Name: (2S)-2-(3H-isoindol-2-ium-1-ylamino)propanoate CAS Name: (2S)-2-(3H-isoindol-2-ium-1-ylamino)propanoate IUPAC Name: (2S)-2-(3H-isoindol-2-ium-1-ylamino)propanoate Traditional Name: (2S)-2-(3H-isoindol-2-ium-1-ylamino)propionate Formula: C11H12N2O2 MolecularWeight: 204.22518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC1=[NH+]CC2=CC=CC=C21

Isomeric SMILES

C[C@@H](C(=O)[O-])NC1=[NH+]CC2=CC=CC=C21

InChI

InChI=1S/C11H12N2O2/c1-7(11(14)15)13-10-9-5-3-2-4-8(9)6-12-10/h2-5,7H,6H2,1H3,(H,12,13)(H,14,15)/t7-/m0/s1