(2S)-2-(2,6-dimethylheptan-4-yloxy)-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-(2,6-dimethylheptan-4-yloxy)-3-phenyl-propanoic acid Openeye Name: (2S)-2-(1-isobutyl-3-methyl-butoxy)-3-phenyl-propanoic acid CAS Name: (2S)-2-(2,6-dimethylheptan-4-yloxy)-3-phenylpropanoic acid IUPAC Name: (2S)-2-(2,6-dimethylheptan-4-yloxy)-3-phenylpropanoic acid Traditional Name: (2S)-2-(1-isobutyl-3-methyl-butoxy)-3-phenyl-propionic acid Formula: C18H28O3 MolecularWeight: 292.41312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28O3/c1-13(2)10-16(11-14(3)4)21-17(18(19)20)12-15-8-6-5-7-9-15/h5-9,13-14,16-17H,10-12H2,1-4H3,(H,19,20)/t17-/m0/s1