(tert-butylamino) 3-(3-methylsulfanylphenyl)propanoate

Systemtic Name: (tert-butylamino) 3-(3-methylsulfanylphenyl)propanoate Openeye Name: (tert-butylamino) 3-(3-methylsulfanylphenyl)propanoate CAS Name: 3-[3-(methylthio)phenyl]propanoic acid (tert-butylamino) ester IUPAC Name: (tert-butylamino) 3-(3-methylsulfanylphenyl)propanoate Traditional Name: 3-[3-(methylthio)phenyl]propionic acid (tert-butylamino) ester Formula: C14H21NO2S MolecularWeight: 267.38704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NOC(=O)CCC1=CC(=CC=C1)SC

Isomeric SMILES

CC(C)(C)NOC(=O)CCC1=CC(=CC=C1)SC

InChI

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