bis(2-methylpropyl) perylene-3,9-dicarboxylate

Systemtic Name: bis(2-methylpropyl) perylene-3,9-dicarboxylate Openeye Name: diisobutyl perylene-3,9-dicarboxylate CAS Name: perylene-3,9-dicarboxylic acid bis(2-methylpropyl) ester IUPAC Name: bis(2-methylpropyl) perylene-3,9-dicarboxylate Traditional Name: perylene-3,9-dicarboxylic acid diisobutyl ester Formula: C30H28O4 MolecularWeight: 452.54092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=C2C3=C4C(=CC=C3)C(=CC=C4C5=C2C1=CC=C5)C(=O)OCC(C)C

Isomeric SMILES

CC(C)COC(=O)C1=CC=C2C3=C4C(=CC=C3)C(=CC=C4C5=C2C1=CC=C5)C(=O)OCC(C)C

InChI

InChI=1S/C30H28O4/c1-17(2)15-33-29(31)25-13-11-23-20-8-6-10-22-26(30(32)34-16-18(3)4)14-12-24(28(20)22)19-7-5-9-21(25)27(19)23/h5-14,17-18H,15-16H2,1-4H3