(2S)-2-cyclopropyl-2-[[(1S)-1-phenylethyl]azaniumyl]ethanoate

Systemtic Name: (2S)-2-cyclopropyl-2-[[(1S)-1-phenylethyl]azaniumyl]ethanoate Openeye Name: (2S)-2-cyclopropyl-2-[[(1S)-1-phenylethyl]ammonio]acetate CAS Name: (2S)-2-cyclopropyl-2-[[(1S)-1-phenylethyl]ammonio]acetate IUPAC Name: (2S)-2-cyclopropyl-2-[[(1S)-1-phenylethyl]azaniumyl]acetate Traditional Name: (2S)-2-cyclopropyl-2-[[(1S)-1-phenylethyl]ammonio]acetate Formula: C13H17NO2 MolecularWeight: 219.27958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH2+]C(C2CC2)C(=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)[NH2+][C@@H](C2CC2)C(=O)[O-]

InChI

InChI=1S/C13H17NO2/c1-9(10-5-3-2-4-6-10)14-12(13(15)16)11-7-8-11/h2-6,9,11-12,14H,7-8H2,1H3,(H,15,16)/t9-,12-/m0/s1