(2S)-2-azaniumyl-3-(2-morpholin-4-ylethylsulfanyl)propanoate

Systemtic Name: (2S)-2-azaniumyl-3-(2-morpholin-4-ylethylsulfanyl)propanoate Openeye Name: (2S)-2-azaniumyl-3-(2-morpholinoethylsulfanyl)propanoate CAS Name: (2S)-2-ammonio-3-[2-(4-morpholinyl)ethylthio]propanoate IUPAC Name: (2S)-2-azaniumyl-3-(2-morpholin-4-ylethylsulfanyl)propanoate Traditional Name: (2S)-2-ammonio-3-(2-morpholinoethylthio)propionate Formula: C9H18N2O3S MolecularWeight: 234.31582

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCSCC(C(=O)[O-])[NH3+]

Isomeric SMILES

C1COCCN1CCSC[C@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C9H18N2O3S/c10-8(9(12)13)7-15-6-3-11-1-4-14-5-2-11/h8H,1-7,10H2,(H,12,13)/t8-/m1/s1