(2S)-3-(4-phenylmethoxyphenyl)-2-[(4-propan-2-ylcyclohexyl)carbonylamino]propanoic acid

Systemtic Name: (2S)-3-(4-phenylmethoxyphenyl)-2-[(4-propan-2-ylcyclohexyl)carbonylamino]propanoic acid Openeye Name: (2S)-3-(4-benzyloxyphenyl)-2-[(4-isopropylcyclohexanecarbonyl)amino]propanoic acid CAS Name: (2S)-2-[[oxo-(4-propan-2-ylcyclohexyl)methyl]amino]-3-(4-phenylmethoxyphenyl)propanoic acid IUPAC Name: (2S)-3-(4-phenylmethoxyphenyl)-2-[(4-propan-2-ylcyclohexanecarbonyl)amino]propanoic acid Traditional Name: (2S)-3-(4-benzoxyphenyl)-2-[(4-isopropylcyclohexanecarbonyl)amino]propionic acid Formula: C26H33NO4 MolecularWeight: 423.54452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CCC(CC1)C(=O)NC(CC2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)C1CCC(CC1)C(=O)N[C@@H](CC2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C26H33NO4/c1-18(2)21-10-12-22(13-11-21)25(28)27-24(26(29)30)16-19-8-14-23(15-9-19)31-17-20-6-4-3-5-7-20/h3-9,14-15,18,21-22,24H,10-13,16-17H2,1-2H3,(H,27,28)(H,29,30)/t21?,22?,24-/m0/s1