3,9-bis[2,2-bis[4-(cyclohexylidenemethyl)phenyl]ethenyl]perylene

Systemtic Name: 3,9-bis[2,2-bis[4-(cyclohexylidenemethyl)phenyl]ethenyl]perylene Openeye Name: 3,9-bis[2,2-bis[4-(cyclohexylidenemethyl)phenyl]vinyl]perylene CAS Name: 3,9-bis[2,2-bis[4-(cyclohexylidenemethyl)phenyl]ethenyl]perylene IUPAC Name: 3,9-bis[2,2-bis[4-(cyclohexylidenemethyl)phenyl]ethenyl]perylene Traditional Name: 3,9-bis[2,2-bis[4-(cyclohexylidenemethyl)phenyl]vinyl]perylene Formula: C76H72 MolecularWeight: 985.38488

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC2=CC=C(C=C2)C(=CC3=CC=C4C5=C6C(=CC=C5)C(=CC=C6C7=C4C3=CC=C7)C=C(C8=CC=C(C=C8)C=C9CCCCC9)C2=CC=C(C=C2)C=C2CCCCC2)C2=CC=C(C=C2)C=C2CCCCC2)CC1

Isomeric SMILES

C1CCC(=CC2=CC=C(C=C2)C(=CC3=CC=C4C5=C6C(=CC=C5)C(=CC=C6C7=C4C3=CC=C7)C=C(C8=CC=C(C=C8)C=C9CCCCC9)C2=CC=C(C=C2)C=C2CCCCC2)C2=CC=C(C=C2)C=C2CCCCC2)CC1

InChI

InChI=1S/C76H72/c1-5-15-53(16-6-1)47-57-27-35-61(36-28-57)73(62-37-29-58(30-38-62)48-54-17-7-2-8-18-54)51-65-43-45-71-70-26-14-24-68-66(44-46-72(76(68)70)69-25-13-23-67(65)75(69)71)52-74(63-39-31-59(32-40-63)49-55-19-9-3-10-20-55)64-41-33-60(34-42-64)50-56-21-11-4-12-22-56/h13-14,23-52H,1-12,15-22H2