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

Systemtic Name: methyl (2S)-3-(4-methanoylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl (2S)-2-(tert-butoxycarbonylamino)-3-(4-formylphenyl)propanoate CAS Name: (2S)-3-(4-formylphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(4-formylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(4-formylphenyl)propionic acid methyl ester Formula: C16H21NO5 MolecularWeight: 307.34164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO5/c1-16(2,3)22-15(20)17-13(14(19)21-4)9-11-5-7-12(10-18)8-6-11/h5-8,10,13H,9H2,1-4H3,(H,17,20)/t13-/m0/s1