dibutyl perylene-1,2-dicarboxylate

Systemtic Name: dibutyl perylene-1,2-dicarboxylate Openeye Name: dibutyl perylene-1,2-dicarboxylate CAS Name: perylene-1,2-dicarboxylic acid dibutyl ester IUPAC Name: dibutyl perylene-1,2-dicarboxylate Traditional Name: perylene-1,2-dicarboxylic acid dibutyl ester Formula: C30H28O4 MolecularWeight: 452.54092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(C2=C3C(=C1)C=CC=C3C4=CC=CC5=C4C2=CC=C5)C(=O)OCCCC

Isomeric SMILES

CCCCOC(=O)C1=C(C2=C3C(=C1)C=CC=C3C4=CC=CC5=C4C2=CC=C5)C(=O)OCCCC

InChI

InChI=1S/C30H28O4/c1-3-5-16-33-29(31)24-18-20-12-9-14-22-21-13-7-10-19-11-8-15-23(25(19)21)27(26(20)22)28(24)30(32)34-17-6-4-2/h7-15,18H,3-6,16-17H2,1-2H3