[(4R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-4,5-dihydro-1,2-oxazol-3-yl] (E)-octadec-9-enoate

Systemtic Name: [(4R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-4,5-dihydro-1,2-oxazol-3-yl] (E)-octadec-9-enoate Openeye Name: [(4R)-4-(tert-butoxycarbonylamino)-4,5-dihydroisoxazol-3-yl] (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid [(4R)-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4,5-dihydroisoxazol-3-yl] ester IUPAC Name: [(4R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-4,5-dihydro-1,2-oxazol-3-yl] (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid [(4R)-4-(tert-butoxycarbonylamino)-2-isoxazolin-3-yl] ester Formula: C26H46N2O5 MolecularWeight: 466.65384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC1=NOCC1NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC1=NOC[C@H]1NC(=O)OC(C)(C)C

InChI

InChI=1S/C26H46N2O5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(29)32-24-22(21-31-28-24)27-25(30)33-26(2,3)4/h12-13,22H,5-11,14-21H2,1-4H3,(H,27,30)/b13-12+/t22-/m1/s1