3-[[4-[1-(4-tert-butylphenoxy)-3-methyl-butyl]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[1-(4-tert-butylphenoxy)-3-methyl-butyl]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[1-(4-tert-butylphenoxy)-3-methyl-butyl]benzoyl]amino]propanoic acid CAS Name: 3-[[[4-[1-(4-tert-butylphenoxy)-3-methylbutyl]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[4-[1-(4-tert-butylphenoxy)-3-methylbutyl]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-[1-(4-tert-butylphenoxy)-3-methyl-butyl]benzoyl]amino]propionic acid Formula: C25H33NO4 MolecularWeight: 411.53382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=C(C=C1)C(=O)NCCC(=O)O)OC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C)CC(C1=CC=C(C=C1)C(=O)NCCC(=O)O)OC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C25H33NO4/c1-17(2)16-22(30-21-12-10-20(11-13-21)25(3,4)5)18-6-8-19(9-7-18)24(29)26-15-14-23(27)28/h6-13,17,22H,14-16H2,1-5H3,(H,26,29)(H,27,28)