2-[[(1S)-1-phenylethyl]-(thiophen-2-ylmethyl)azaniumyl]ethanoate

Systemtic Name: 2-[[(1S)-1-phenylethyl]-(thiophen-2-ylmethyl)azaniumyl]ethanoate Openeye Name: 2-[[(1S)-1-phenylethyl]-(2-thienylmethyl)ammonio]acetate CAS Name: 2-[[(1S)-1-phenylethyl]-(thiophen-2-ylmethyl)ammonio]acetate IUPAC Name: 2-[[(1S)-1-phenylethyl]-(thiophen-2-ylmethyl)azaniumyl]acetate Traditional Name: 2-[[(1S)-1-phenylethyl]-(2-thenyl)ammonio]acetate Formula: C15H17NO2S MolecularWeight: 275.36598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH+](CC2=CC=CS2)CC(=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)[NH+](CC2=CC=CS2)CC(=O)[O-]

InChI

InChI=1S/C15H17NO2S/c1-12(13-6-3-2-4-7-13)16(11-15(17)18)10-14-8-5-9-19-14/h2-9,12H,10-11H2,1H3,(H,17,18)/t12-/m0/s1