(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-octadecoxyphenyl)propanoic acid

Systemtic Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-octadecoxyphenyl)propanoic acid Openeye Name: (2S)-2-(tert-butoxycarbonylamino)-3-(4-octadecoxyphenyl)propanoic acid CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(4-octadecoxyphenyl)propanoic acid IUPAC Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-octadecoxyphenyl)propanoic acid Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(4-stearyloxyphenyl)propionic acid Formula: C32H55NO5 MolecularWeight: 533.7828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C32H55NO5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-37-28-23-21-27(22-24-28)26-29(30(34)35)33-31(36)38-32(2,3)4/h21-24,29H,5-20,25-26H2,1-4H3,(H,33,36)(H,34,35)/t29-/m0/s1