[(2-methylpropan-2-yl)oxycarbonylamino] 2-[3-(methylsulfanylmethyl)-4-oxidanyl-phenyl]ethanoate

Systemtic Name: [(2-methylpropan-2-yl)oxycarbonylamino] 2-[3-(methylsulfanylmethyl)-4-oxidanyl-phenyl]ethanoate Openeye Name: (tert-butoxycarbonylamino) 2-[4-hydroxy-3-(methylsulfanylmethyl)phenyl]acetate CAS Name: 2-[4-hydroxy-3-[(methylthio)methyl]phenyl]acetic acid [[(2-methylpropan-2-yl)oxy-oxomethyl]amino] ester IUPAC Name: [(2-methylpropan-2-yl)oxycarbonylamino] 2-[4-hydroxy-3-(methylsulfanylmethyl)phenyl]acetate Traditional Name: 2-[4-hydroxy-3-[(methylthio)methyl]phenyl]acetic acid (tert-butoxycarbonylamino) ester Formula: C15H21NO5S MolecularWeight: 327.39594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NOC(=O)CC1=CC(=C(C=C1)O)CSC

Isomeric SMILES

CC(C)(C)OC(=O)NOC(=O)CC1=CC(=C(C=C1)O)CSC

InChI

InChI=1S/C15H21NO5S/c1-15(2,3)20-14(19)16-21-13(18)8-10-5-6-12(17)11(7-10)9-22-4/h5-7,17H,8-9H2,1-4H3,(H,16,19)