(2S)-2-(2-methyl-1H-indol-3-yl)-2-thiomorpholin-4-ium-4-yl-ethanoate

Systemtic Name: (2S)-2-(2-methyl-1H-indol-3-yl)-2-thiomorpholin-4-ium-4-yl-ethanoate Openeye Name: (2S)-2-(2-methyl-1H-indol-3-yl)-2-thiomorpholin-4-ium-4-yl-acetate CAS Name: (2S)-2-(2-methyl-1H-indol-3-yl)-2-(4-thiomorpholin-4-iumyl)acetate IUPAC Name: (2S)-2-(2-methyl-1H-indol-3-yl)-2-thiomorpholin-4-ium-4-ylacetate Traditional Name: (2S)-2-(2-methyl-1H-indol-3-yl)-2-thiomorpholin-4-ium-4-yl-acetate Formula: C15H18N2O2S MolecularWeight: 290.38062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(C(=O)[O-])[NH+]3CCSCC3

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)[C@@H](C(=O)[O-])[NH+]3CCSCC3

InChI

InChI=1S/C15H18N2O2S/c1-10-13(11-4-2-3-5-12(11)16-10)14(15(18)19)17-6-8-20-9-7-17/h2-5,14,16H,6-9H2,1H3,(H,18,19)/t14-/m0/s1