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

Systemtic Name: (2S)-3-methyl-2-[2-[4-(2-methylpropyl)phenyl]propanoylamino]butanoic acid Openeye Name: (2S)-2-[2-(4-isobutylphenyl)propanoylamino]-3-methyl-butanoic acid CAS Name: (2S)-3-methyl-2-[[2-[4-(2-methylpropyl)phenyl]-1-oxopropyl]amino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[2-[4-(2-methylpropyl)phenyl]propanoylamino]butanoic acid Traditional Name: (2S)-2-[2-(4-isobutylphenyl)propanoylamino]-3-methyl-butyric acid Formula: C18H27NO3 MolecularWeight: 305.41188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27NO3/c1-11(2)10-14-6-8-15(9-7-14)13(5)17(20)19-16(12(3)4)18(21)22/h6-9,11-13,16H,10H2,1-5H3,(H,19,20)(H,21,22)/t13?,16-/m0/s1