[(2S,3S,5R)-2-azido-3,5-bis(phenylcarbonyloxy)oct-7-enyl] benzoate

Systemtic Name: [(2S,3S,5R)-2-azido-3,5-bis(phenylcarbonyloxy)oct-7-enyl] benzoate Openeye Name: [(2S,3S,5R)-2-azido-3,5-dibenzoyloxy-oct-7-enyl] benzoate CAS Name: benzoic acid [(2S,3S,5R)-2-azido-3,5-dibenzoyloxyoct-7-enyl] ester IUPAC Name: [(2S,3S,5R)-2-azido-3,5-dibenzoyloxyoct-7-enyl] benzoate Traditional Name: benzoic acid [(2S,3S,5R)-2-azido-3,5-dibenzoyloxy-oct-7-enyl] ester Formula: C29H27N3O6 MolecularWeight: 513.54118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CC(C(COC(=O)C1=CC=CC=C1)N=[N+]=[N-])OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C=CC[C@H](C[C@@H]([C@H](COC(=O)C1=CC=CC=C1)N=[N+]=[N-])OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C29H27N3O6/c1-2-12-24(37-28(34)22-15-8-4-9-16-22)19-26(38-29(35)23-17-10-5-11-18-23)25(31-32-30)20-36-27(33)21-13-6-3-7-14-21/h2-11,13-18,24-26H,1,12,19-20H2/t24-,25+,26+/m1/s1