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2-[2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]ethanethioic S-acid

2-[2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]ethanethioic S-acid

Systemtic Name:2-[2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]ethanethioic S-acid
Openeye Name:2-[2-[(tert-butoxycarbonylamino)methyl]phenyl]ethanethioic S-acid
CAS Name:2-[2-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]phenyl]ethanethioic S-acid
IUPAC Name:2-[2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]ethanethioic S-acid
Traditional Name:2-[2-[(tert-butoxycarbonylamino)methyl]phenyl]thioacetic acid
Formula: C14H19NO3S
MolecularWeight: 281.37056
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=CC=C1CC(=O)S


Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=CC=C1CC(=O)S


InChI

InChI=1S/C14H19NO3S/c1-14(2,3)18-13(17)15-9-11-7-5-4-6-10(11)8-12(16)19/h4-7H,8-9H2,1-3H3,(H,15,17)(H,16,19)


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