tert-butyl (2S)-2-[[(2S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-propanoyl]amino]-3-phenyl-propanoate

Systemtic Name: tert-butyl (2S)-2-[[(2S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-propanoyl]amino]-3-phenyl-propanoate Openeye Name: tert-butyl (2S)-2-[[(2S)-3-(tert-butoxycarbonylamino)-2-hydroxy-propanoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(2S)-2-hydroxy-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]amino]-3-phenylpropanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[(2S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[(2S)-3-(tert-butoxycarbonylamino)-2-hydroxy-propanoyl]amino]-3-phenyl-propionic acid tert-butyl ester Formula: C21H32N2O6 MolecularWeight: 408.48858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC=CC=C1)NC(=O)C(CNC(=O)OC(C)(C)C)O

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CNC(=O)OC(C)(C)C)O

InChI

InChI=1S/C21H32N2O6/c1-20(2,3)28-18(26)15(12-14-10-8-7-9-11-14)23-17(25)16(24)13-22-19(27)29-21(4,5)6/h7-11,15-16,24H,12-13H2,1-6H3,(H,22,27)(H,23,25)/t15-,16-/m0/s1