methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-(2-oxidanylidenepropoxy)phenyl]propanoate

Systemtic Name: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-(2-oxidanylidenepropoxy)phenyl]propanoate Openeye Name: methyl (2S)-3-(4-acetonyloxyphenyl)-2-(tert-butoxycarbonylamino)propanoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[4-(2-oxopropoxy)phenyl]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-(2-oxopropoxy)phenyl]propanoate Traditional Name: (2S)-3-(4-acetonyloxyphenyl)-2-(tert-butoxycarbonylamino)propionic acid methyl ester Formula: C18H25NO6 MolecularWeight: 351.3942

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC1=CC=C(C=C1)CC(C(=O)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)COC1=CC=C(C=C1)C[C@@H](C(=O)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C18H25NO6/c1-12(20)11-24-14-8-6-13(7-9-14)10-15(16(21)23-5)19-17(22)25-18(2,3)4/h6-9,15H,10-11H2,1-5H3,(H,19,22)/t15-/m0/s1