5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(4-phenylmethoxyphenyl)-2-(phenylmethyl)hexanoic acid

Systemtic Name: 5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(4-phenylmethoxyphenyl)-2-(phenylmethyl)hexanoic acid Openeye Name: 2-benzyl-6-(4-benzyloxyphenyl)-5-(tert-butoxycarbonylamino)hexanoic acid CAS Name: 5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-(4-phenylmethoxyphenyl)-2-(phenylmethyl)hexanoic acid IUPAC Name: 2-benzyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(4-phenylmethoxyphenyl)hexanoic acid Traditional Name: 6-(4-benzoxyphenyl)-2-benzyl-5-(tert-butoxycarbonylamino)hexanoic acid Formula: C31H37NO5 MolecularWeight: 503.62918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC(CC1=CC=CC=C1)C(=O)O)CC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCC(CC1=CC=CC=C1)C(=O)O)CC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C31H37NO5/c1-31(2,3)37-30(35)32-27(17-16-26(29(33)34)20-23-10-6-4-7-11-23)21-24-14-18-28(19-15-24)36-22-25-12-8-5-9-13-25/h4-15,18-19,26-27H,16-17,20-22H2,1-3H3,(H,32,35)(H,33,34)