3-(2-fluorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-sulfanyl-propanoate

Systemtic Name: 3-(2-fluorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-sulfanyl-propanoate Openeye Name: 3-(tert-butoxycarbonylamino)-3-(2-fluorophenyl)-2-sulfanyl-propanoate CAS Name: 3-(2-fluorophenyl)-2-mercapto-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoate IUPAC Name: 3-(2-fluorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-sulfanylpropanoate Traditional Name: 3-(tert-butoxycarbonylamino)-3-(2-fluorophenyl)-2-mercapto-propionate Formula: C14H17FNO4S- MolecularWeight: 314.352483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C1=CC=CC=C1F)C(C(=O)[O-])S

Isomeric SMILES

CC(C)(C)OC(=O)NC(C1=CC=CC=C1F)C(C(=O)[O-])S

InChI

InChI=1S/C14H18FNO4S/c1-14(2,3)20-13(19)16-10(11(21)12(17)18)8-6-4-5-7-9(8)15/h4-7,10-11,21H,1-3H3,(H,16,19)(H,17,18)/p-1