(2S)-3-(2,6-diethyl-4-oxidanyl-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Systemtic Name: (2S)-3-(2,6-diethyl-4-oxidanyl-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: (2S)-2-(tert-butoxycarbonylamino)-3-(2,6-diethyl-4-hydroxy-phenyl)propanoic acid CAS Name: (2S)-3-(2,6-diethyl-4-hydroxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: (2S)-3-(2,6-diethyl-4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(2,6-diethyl-4-hydroxy-phenyl)propionic acid Formula: C18H27NO5 MolecularWeight: 337.41068

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1CC(C(=O)O)NC(=O)OC(C)(C)C)CC)O

Isomeric SMILES

CCC1=CC(=CC(=C1C[C@@H](C(=O)O)NC(=O)OC(C)(C)C)CC)O

InChI

InChI=1S/C18H27NO5/c1-6-11-8-13(20)9-12(7-2)14(11)10-15(16(21)22)19-17(23)24-18(3,4)5/h8-9,15,20H,6-7,10H2,1-5H3,(H,19,23)(H,21,22)/t15-/m0/s1