dimethyl 4,5-bis(1-adamantyl)-3,6-dimethyl-benzene-1,2-dicarboxylate

Systemtic Name: dimethyl 4,5-bis(1-adamantyl)-3,6-dimethyl-benzene-1,2-dicarboxylate Openeye Name: dimethyl 4,5-bis(1-adamantyl)-3,6-dimethyl-benzene-1,2-dicarboxylate CAS Name: 4,5-bis(1-adamantyl)-3,6-dimethylbenzene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4,5-bis(1-adamantyl)-3,6-dimethylbenzene-1,2-dicarboxylate Traditional Name: 4,5-bis(1-adamantyl)-3,6-dimethyl-benzene-1,2-dicarboxylic acid dimethyl ester Formula: C32H42O4 MolecularWeight: 490.67348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C(=O)OC)C(=O)OC)C)C23CC4CC(C2)CC(C4)C3)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CC1=C(C(=C(C(=C1C(=O)OC)C(=O)OC)C)C23CC4CC(C2)CC(C4)C3)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C32H42O4/c1-17-25(29(33)35-3)26(30(34)36-4)18(2)28(32-14-22-8-23(15-32)10-24(9-22)16-32)27(17)31-11-19-5-20(12-31)7-21(6-19)13-31/h19-24H,5-16H2,1-4H3