3,6-diphenyloctyl hydrogen carbonate

Systemtic Name: 3,6-diphenyloctyl hydrogen carbonate Openeye Name: 3,6-diphenyloctyl hydrogen carbonate CAS Name: carbonic acid 3,6-diphenyloctyl ester IUPAC Name: 3,6-diphenyloctyl hydrogen carbonate Traditional Name: carbonic acid 3,6-diphenyloctyl ester Formula: C21H26O3 MolecularWeight: 326.42934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(CCOC(=O)O)C1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CCC(CCC(CCOC(=O)O)C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C21H26O3/c1-2-17(18-9-5-3-6-10-18)13-14-20(15-16-24-21(22)23)19-11-7-4-8-12-19/h3-12,17,20H,2,13-16H2,1H3,(H,22,23)