O2-(2-adamantyl) O1-propyl benzene-1,2-dicarboxylate

Systemtic Name: O2-(2-adamantyl) O1-propyl benzene-1,2-dicarboxylate Openeye Name: O2-(2-adamantyl) O1-propyl benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid O2-(2-adamantyl) ester O1-propyl ester IUPAC Name: 2-O-(2-adamantyl) 1-O-propyl benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid O2-(2-adamantyl) ester O1-propyl ester Formula: C21H26O4 MolecularWeight: 342.42874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=CC=C1C(=O)OC2C3CC4CC(C3)CC2C4

Isomeric SMILES

CCCOC(=O)C1=CC=CC=C1C(=O)OC2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C21H26O4/c1-2-7-24-20(22)17-5-3-4-6-18(17)21(23)25-19-15-9-13-8-14(11-15)12-16(19)10-13/h3-6,13-16,19H,2,7-12H2,1H3