phenyl 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]butanoate

Systemtic Name: phenyl 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]butanoate Openeye Name: phenyl 2-(tert-butoxycarbonylamino)-3-tert-butoxycarbonylsulfanyl-3-methyl-butanoate CAS Name: 3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]thio]butanoic acid phenyl ester IUPAC Name: phenyl 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]butanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-(tert-butoxycarbonylthio)-3-methyl-butyric acid phenyl ester Formula: C21H31NO6S MolecularWeight: 425.53894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C(=O)OC1=CC=CC=C1)C(C)(C)SC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NC(C(=O)OC1=CC=CC=C1)C(C)(C)SC(=O)OC(C)(C)C

InChI

InChI=1S/C21H31NO6S/c1-19(2,3)27-17(24)22-15(16(23)26-14-12-10-9-11-13-14)21(7,8)29-18(25)28-20(4,5)6/h9-13,15H,1-8H3,(H,22,24)