(2R,4S)-4-[(2-methylpropan-2-yl)oxycarbonyl]-2-phenethyl-octanoic acid

Systemtic Name: (2R,4S)-4-[(2-methylpropan-2-yl)oxycarbonyl]-2-phenethyl-octanoic acid Openeye Name: (2R,4S)-4-tert-butoxycarbonyl-2-phenethyl-octanoic acid CAS Name: (2R,4S)-4-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-phenethyloctanoic acid IUPAC Name: (2R,4S)-4-[(2-methylpropan-2-yl)oxycarbonyl]-2-phenethyloctanoic acid Traditional Name: (2R,4S)-4-tert-butoxycarbonyl-2-phenethyl-caprylic acid Formula: C21H32O4 MolecularWeight: 348.47638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(CCC1=CC=CC=C1)C(=O)O)C(=O)OC(C)(C)C

Isomeric SMILES

CCCC[C@@H](C[C@@H](CCC1=CC=CC=C1)C(=O)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H32O4/c1-5-6-12-18(20(24)25-21(2,3)4)15-17(19(22)23)14-13-16-10-8-7-9-11-16/h7-11,17-18H,5-6,12-15H2,1-4H3,(H,22,23)/t17-,18+/m1/s1