(2S)-2-[2-[4-(2-methylpropyl)phenyl]propanoylamino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[2-[4-(2-methylpropyl)phenyl]propanoylamino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[2-(4-isobutylphenyl)propanoylamino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[[2-[4-(2-methylpropyl)phenyl]-1-oxopropyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[2-[4-(2-methylpropyl)phenyl]propanoylamino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[2-(4-isobutylphenyl)propanoylamino]-3-phenyl-propionic acid Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)C(=O)NC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C22H27NO3/c1-15(2)13-18-9-11-19(12-10-18)16(3)21(24)23-20(22(25)26)14-17-7-5-4-6-8-17/h4-12,15-16,20H,13-14H2,1-3H3,(H,23,24)(H,25,26)/t16?,20-/m0/s1