(2S)-3-(3,4-diethoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Systemtic Name: (2S)-3-(3,4-diethoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: (2S)-2-(tert-butoxycarbonylamino)-3-(3,4-diethoxyphenyl)propanoic acid CAS Name: (2S)-3-(3,4-diethoxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: (2S)-3-(3,4-diethoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(3,4-diethoxyphenyl)propionic acid Formula: C18H27NO6 MolecularWeight: 353.41008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC(C(=O)O)NC(=O)OC(C)(C)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[C@@H](C(=O)O)NC(=O)OC(C)(C)C)OCC

InChI

InChI=1S/C18H27NO6/c1-6-23-14-9-8-12(11-15(14)24-7-2)10-13(16(20)21)19-17(22)25-18(3,4)5/h8-9,11,13H,6-7,10H2,1-5H3,(H,19,22)(H,20,21)/t13-/m0/s1