2-[(2-methylpropan-2-yl)oxycarbonyl-(4-octadecoxyphenyl)amino]butanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonyl-(4-octadecoxyphenyl)amino]butanoic acid Openeye Name: 2-(N-tert-butoxycarbonyl-4-octadecoxy-anilino)butanoic acid CAS Name: 2-(N-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-octadecoxyanilino)butanoic acid IUPAC Name: 2-[N-[(2-methylpropan-2-yl)oxycarbonyl]-4-octadecoxyanilino]butanoic acid Traditional Name: 2-(N-tert-butoxycarbonyl-4-stearyloxy-anilino)butyric acid Formula: C33H57NO5 MolecularWeight: 547.80938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)N(C(CC)C(=O)O)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)N(C(CC)C(=O)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C33H57NO5/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27-38-29-25-23-28(24-26-29)34(30(7-2)31(35)36)32(37)39-33(3,4)5/h23-26,30H,6-22,27H2,1-5H3,(H,35,36)