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tert-butyl 3-azanyl-2-(3-methylsulfanylphenyl)propanoate

tert-butyl 3-azanyl-2-(3-methylsulfanylphenyl)propanoate

Systemtic Name:tert-butyl 3-azanyl-2-(3-methylsulfanylphenyl)propanoate
Openeye Name:tert-butyl 3-amino-2-(3-methylsulfanylphenyl)propanoate
CAS Name:3-amino-2-[3-(methylthio)phenyl]propanoic acid tert-butyl ester
IUPAC Name:tert-butyl 3-amino-2-(3-methylsulfanylphenyl)propanoate
Traditional Name:3-amino-2-[3-(methylthio)phenyl]propionic acid tert-butyl ester
Formula: C14H21NO2S
MolecularWeight: 267.38704
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CN)C1=CC(=CC=C1)SC


Isomeric SMILES

CC(C)(C)OC(=O)C(CN)C1=CC(=CC=C1)SC


InChI

InChI=1S/C14H21NO2S/c1-14(2,3)17-13(16)12(9-15)10-6-5-7-11(8-10)18-4/h5-8,12H,9,15H2,1-4H3


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