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

Systemtic Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(3-phenyl-4-phenylmethoxy-phenyl)propanoic acid Openeye Name: (2S)-3-(4-benzyloxy-3-phenyl-phenyl)-2-(tert-butoxycarbonylamino)propanoic acid CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(3-phenyl-4-phenylmethoxyphenyl)propanoic acid IUPAC Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(3-phenyl-4-phenylmethoxyphenyl)propanoic acid Traditional Name: (2S)-3-(4-benzoxy-3-phenyl-phenyl)-2-(tert-butoxycarbonylamino)propionic acid Formula: C27H29NO5 MolecularWeight: 447.52286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C27H29NO5/c1-27(2,3)33-26(31)28-23(25(29)30)17-20-14-15-24(32-18-19-10-6-4-7-11-19)22(16-20)21-12-8-5-9-13-21/h4-16,23H,17-18H2,1-3H3,(H,28,31)(H,29,30)/t23-/m0/s1