(3,6,7,10,11-pentapentoxytriphenylen-2-yl) cyclohexanecarboxylate

Systemtic Name: (3,6,7,10,11-pentapentoxytriphenylen-2-yl) cyclohexanecarboxylate Openeye Name: (3,6,7,10,11-pentapentoxytriphenylen-2-yl) cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid (3,6,7,10,11-pentapentoxy-2-triphenylenyl) ester IUPAC Name: (3,6,7,10,11-pentapentoxytriphenylen-2-yl) cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid (3,6,7,10,11-pentaamoxytriphenylen-2-yl) ester Formula: C50H72O7 MolecularWeight: 785.10248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)OCCCCC)OC(=O)C5CCCCC5)OCCCCC)OCCCCC)OCCCCC

Isomeric SMILES

CCCCCOC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)OCCCCC)OC(=O)C5CCCCC5)OCCCCC)OCCCCC)OCCCCC

InChI

InChI=1S/C50H72O7/c1-6-11-19-26-52-44-31-38-39-32-45(53-27-20-12-7-2)47(55-29-22-14-9-4)34-41(39)43-36-49(57-50(51)37-24-17-16-18-25-37)48(56-30-23-15-10-5)35-42(43)40(38)33-46(44)54-28-21-13-8-3/h31-37H,6-30H2,1-5H3