(2R)-2-azaniumyl-3-[(4-tert-butylphenyl)methylsulfanyl]propanoate

Systemtic Name: (2R)-2-azaniumyl-3-[(4-tert-butylphenyl)methylsulfanyl]propanoate Openeye Name: (2R)-2-azaniumyl-3-[(4-tert-butylphenyl)methylsulfanyl]propanoate CAS Name: (2R)-2-ammonio-3-[(4-tert-butylphenyl)methylthio]propanoate IUPAC Name: (2R)-2-azaniumyl-3-[(4-tert-butylphenyl)methylsulfanyl]propanoate Traditional Name: (2R)-2-ammonio-3-[(4-tert-butylbenzyl)thio]propionate Formula: C14H21NO2S MolecularWeight: 267.38704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSCC(C(=O)[O-])[NH3+]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC[C@@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C14H21NO2S/c1-14(2,3)11-6-4-10(5-7-11)8-18-9-12(15)13(16)17/h4-7,12H,8-9,15H2,1-3H3,(H,16,17)/t12-/m0/s1