[(2S,3S,4R)-2-azido-1,3-bis(phenylmethoxy)hexadecan-4-yl] ethanoate

Systemtic Name: [(2S,3S,4R)-2-azido-1,3-bis(phenylmethoxy)hexadecan-4-yl] ethanoate Openeye Name: [(1R)-1-[(1S,2S)-2-azido-1,3-dibenzyloxy-propyl]tridecyl] acetate CAS Name: acetic acid [(2S,3S,4R)-2-azido-1,3-bis(phenylmethoxy)hexadecan-4-yl] ester IUPAC Name: [(2S,3S,4R)-2-azido-1,3-bis(phenylmethoxy)hexadecan-4-yl] acetate Traditional Name: acetic acid [(1R)-1-[(1S,2S)-2-azido-1,3-dibenzoxy-propyl]tridecyl] ester Formula: C32H47N3O4 MolecularWeight: 537.73328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(C(COCC1=CC=CC=C1)N=[N+]=[N-])OCC2=CC=CC=C2)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCC[C@H]([C@H]([C@H](COCC1=CC=CC=C1)N=[N+]=[N-])OCC2=CC=CC=C2)OC(=O)C

InChI

InChI=1S/C32H47N3O4/c1-3-4-5-6-7-8-9-10-11-18-23-31(39-27(2)36)32(38-25-29-21-16-13-17-22-29)30(34-35-33)26-37-24-28-19-14-12-15-20-28/h12-17,19-22,30-32H,3-11,18,23-26H2,1-2H3/t30-,31+,32-/m0/s1