3-[4-tert-butyl-3-[3-(2,3,4-trimethoxyphenyl)octanoylamino]phenyl]propanoic acid

Systemtic Name: 3-[4-tert-butyl-3-[3-(2,3,4-trimethoxyphenyl)octanoylamino]phenyl]propanoic acid Openeye Name: 3-[4-tert-butyl-3-[3-(2,3,4-trimethoxyphenyl)octanoylamino]phenyl]propanoic acid CAS Name: 3-[4-tert-butyl-3-[[1-oxo-3-(2,3,4-trimethoxyphenyl)octyl]amino]phenyl]propanoic acid IUPAC Name: 3-[4-tert-butyl-3-[3-(2,3,4-trimethoxyphenyl)octanoylamino]phenyl]propanoic acid Traditional Name: 3-[4-tert-butyl-3-[3-(2,3,4-trimethoxyphenyl)octanoylamino]phenyl]propionic acid Formula: C30H43NO6 MolecularWeight: 513.66552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)NC1=C(C=CC(=C1)CCC(=O)O)C(C)(C)C)C2=C(C(=C(C=C2)OC)OC)OC

Isomeric SMILES

CCCCCC(CC(=O)NC1=C(C=CC(=C1)CCC(=O)O)C(C)(C)C)C2=C(C(=C(C=C2)OC)OC)OC

InChI

InChI=1S/C30H43NO6/c1-8-9-10-11-21(22-14-16-25(35-5)29(37-7)28(22)36-6)19-26(32)31-24-18-20(13-17-27(33)34)12-15-23(24)30(2,3)4/h12,14-16,18,21H,8-11,13,17,19H2,1-7H3,(H,31,32)(H,33,34)