phenyl cycloicosanecarboxylate

Systemtic Name: phenyl cycloicosanecarboxylate Openeye Name: phenyl cycloicosanecarboxylate CAS Name: cycloeicosanecarboxylic acid phenyl ester IUPAC Name: phenyl cycloicosanecarboxylate Traditional Name: cycloeicosanecarboxylic acid phenyl ester Formula: C27H44O2 MolecularWeight: 400.63706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCCCCCC(CCCCCCCCC1)C(=O)OC2=CC=CC=C2

Isomeric SMILES

C1CCCCCCCCCC(CCCCCCCCC1)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C27H44O2/c28-27(29-26-23-19-16-20-24-26)25-21-17-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-18-22-25/h16,19-20,23-25H,1-15,17-18,21-22H2