3-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoyloxy]-3-phenylmethoxy-phenyl]propanoic acid

Systemtic Name: 3-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoyloxy]-3-phenylmethoxy-phenyl]propanoic acid Openeye Name: 3-[3-benzyloxy-4-[2-(tert-butoxycarbonylamino)acetyl]oxy-phenyl]propanoic acid CAS Name: 3-[4-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethoxy]-3-phenylmethoxyphenyl]propanoic acid IUPAC Name: 3-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]oxy-3-phenylmethoxyphenyl]propanoic acid Traditional Name: 3-[3-benzoxy-4-[2-(tert-butoxycarbonylamino)acetyl]oxy-phenyl]propionic acid Formula: C23H27NO7 MolecularWeight: 429.46298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(=O)OC1=C(C=C(C=C1)CCC(=O)O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NCC(=O)OC1=C(C=C(C=C1)CCC(=O)O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H27NO7/c1-23(2,3)31-22(28)24-14-21(27)30-18-11-9-16(10-12-20(25)26)13-19(18)29-15-17-7-5-4-6-8-17/h4-9,11,13H,10,12,14-15H2,1-3H3,(H,24,28)(H,25,26)