[(2S,3R)-2-methyl-1-oxidanylidene-hexadecan-3-yl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxy-propanoate

Systemtic Name: [(2S,3R)-2-methyl-1-oxidanylidene-hexadecan-3-yl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxy-propanoate Openeye Name: [(1R)-1-[(1S)-1-methyl-2-oxo-ethyl]tetradecyl] (2S)-3-benzyloxy-2-(tert-butoxycarbonylamino)propanoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-phenylmethoxypropanoic acid [(2S,3R)-2-methyl-1-oxohexadecan-3-yl] ester IUPAC Name: [(2S,3R)-2-methyl-1-oxohexadecan-3-yl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxypropanoate Traditional Name: (2S)-3-benzoxy-2-(tert-butoxycarbonylamino)propionic acid [(1R)-1-[(1S)-2-keto-1-methyl-ethyl]tetradecyl] ester Formula: C32H53NO6 MolecularWeight: 547.76632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(C(C)C=O)OC(=O)C(COCC1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCC[C@H]([C@H](C)C=O)OC(=O)[C@H](COCC1=CC=CC=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C32H53NO6/c1-6-7-8-9-10-11-12-13-14-15-19-22-29(26(2)23-34)38-30(35)28(33-31(36)39-32(3,4)5)25-37-24-27-20-17-16-18-21-27/h16-18,20-21,23,26,28-29H,6-15,19,22,24-25H2,1-5H3,(H,33,36)/t26-,28+,29-/m1/s1