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

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonyl-(4-octadecoxyphenyl)amino]ethanoic acid Openeye Name: 2-(N-tert-butoxycarbonyl-4-octadecoxy-anilino)acetic acid CAS Name: 2-(N-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-octadecoxyanilino)acetic acid IUPAC Name: 2-[N-[(2-methylpropan-2-yl)oxycarbonyl]-4-octadecoxyanilino]acetic acid Traditional Name: 2-(N-tert-butoxycarbonyl-4-stearyloxy-anilino)acetic acid Formula: C31H53NO5 MolecularWeight: 519.75622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H53NO5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-36-28-23-21-27(22-24-28)32(26-29(33)34)30(35)37-31(2,3)4/h21-24H,5-20,25-26H2,1-4H3,(H,33,34)