[9-ethoxycarbonyloxy-5,5-bis(phenylmethoxymethyl)nona-2,7-diynyl] ethyl carbonate

Systemtic Name: [9-ethoxycarbonyloxy-5,5-bis(phenylmethoxymethyl)nona-2,7-diynyl] ethyl carbonate Openeye Name: [5,5-bis(benzyloxymethyl)-9-ethoxycarbonyloxy-nona-2,7-diynyl] ethyl carbonate CAS Name: carbonic acid [9-ethoxycarbonyloxy-5,5-bis(phenylmethoxymethyl)nona-2,7-diynyl] ethyl ester IUPAC Name: [9-ethoxycarbonyloxy-5,5-bis(phenylmethoxymethyl)nona-2,7-diynyl] ethyl carbonate Traditional Name: carbonic acid [5,5-bis(benzoxymethyl)-9-carbethoxyoxy-nona-2,7-diynyl] ethyl ester Formula: C31H36O8 MolecularWeight: 536.61274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OCC#CCC(CC#CCOC(=O)OCC)(COCC1=CC=CC=C1)COCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)OCC#CCC(CC#CCOC(=O)OCC)(COCC1=CC=CC=C1)COCC2=CC=CC=C2

InChI

InChI=1S/C31H36O8/c1-3-36-29(32)38-21-13-11-19-31(20-12-14-22-39-30(33)37-4-2,25-34-23-27-15-7-5-8-16-27)26-35-24-28-17-9-6-10-18-28/h5-10,15-18H,3-4,19-26H2,1-2H3