1,2-bis(4-propan-2-ylphenyl)perylene-3,9-dicarboxylic acid

Systemtic Name: 1,2-bis(4-propan-2-ylphenyl)perylene-3,9-dicarboxylic acid Openeye Name: 1,2-bis(4-isopropylphenyl)perylene-3,9-dicarboxylic acid CAS Name: 1,2-bis(4-propan-2-ylphenyl)perylene-3,9-dicarboxylic acid IUPAC Name: 1,2-bis(4-propan-2-ylphenyl)perylene-3,9-dicarboxylic acid Traditional Name: 1,2-bis(p-cumenyl)perylene-3,9-dicarboxylic acid Formula: C40H32O4 MolecularWeight: 576.67968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=C3C4=C5C(=CC=C4)C(=CC=C5C6=C3C(=CC=C6)C(=C2C7=CC=C(C=C7)C(C)C)C(=O)O)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=C3C4=C5C(=CC=C4)C(=CC=C5C6=C3C(=CC=C6)C(=C2C7=CC=C(C=C7)C(C)C)C(=O)O)C(=O)O

InChI

InChI=1S/C40H32O4/c1-21(2)23-11-15-25(16-12-23)33-34(26-17-13-24(14-18-26)22(3)4)38(40(43)44)32-10-5-7-27-29-19-20-30(39(41)42)28-8-6-9-31(35(28)29)37(33)36(27)32/h5-22H,1-4H3,(H,41,42)(H,43,44)