10-[2,3-bis(10-anthracen-9-ylcarbonyloxydecoxy)propoxy]decyl anthracene-9-carboxylate

Systemtic Name: 10-[2,3-bis(10-anthracen-9-ylcarbonyloxydecoxy)propoxy]decyl anthracene-9-carboxylate Openeye Name: 10-[2,3-bis[10-(anthracene-9-carbonyloxy)decoxy]propoxy]decyl anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid 10-[2,3-bis[10-[9-anthracenyl(oxo)methoxy]decoxy]propoxy]decyl ester IUPAC Name: 10-[2,3-bis[10-(anthracene-9-carbonyloxy)decoxy]propoxy]decyl anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid 10-[2,3-bis[10-(anthracene-9-carbonyloxy)decoxy]propoxy]decyl ester Formula: C78H92O9 MolecularWeight: 1173.55968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C(=O)OCCCCCCCCCCOCC(COCCCCCCCCCCOC(=O)C4=C5C=CC=CC5=CC6=CC=CC=C64)OCCCCCCCCCCOC(=O)C7=C8C=CC=CC8=CC9=CC=CC=C97

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C(=O)OCCCCCCCCCCOCC(COCCCCCCCCCCOC(=O)C4=C5C=CC=CC5=CC6=CC=CC=C64)OCCCCCCCCCCOC(=O)C7=C8C=CC=CC8=CC9=CC=CC=C97

InChI

InChI=1S/C78H92O9/c79-76(73-67-43-25-19-37-60(67)55-61-38-20-26-44-68(61)73)85-52-34-16-10-3-1-7-13-31-49-82-58-66(84-51-33-15-9-5-6-12-18-36-54-87-78(81)75-71-47-29-23-41-64(71)57-65-42-24-30-48-72(65)75)59-83-50-32-14-8-2-4-11-17-35-53-86-77(80)74-69-45-27-21-39-62(69)56-63-40-22-28-46-70(63)74/h19-30,37-48,55-57,66H,1-18,31-36,49-54,58-59H2