methyl (2R)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methyl (2R)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl (2R)-2-(tert-butoxycarbonylamino)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl-propanoate CAS Name: (2R)-3-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2R)-2-(tert-butoxycarbonylamino)-3-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]propionic acid methyl ester Formula: C23H37NO5S MolecularWeight: 439.60858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SCC(C(=O)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC[C@@H](C(=O)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C23H37NO5S/c1-21(2,3)15-11-14(12-16(18(15)25)22(4,5)6)30-13-17(19(26)28-10)24-20(27)29-23(7,8)9/h11-12,17,25H,13H2,1-10H3,(H,24,27)/t17-/m0/s1