trinonyl (2Z)-3-[(1E)-cycloocten-1-yl]cyclooct-2-ene-1,1,2-tricarboxylate

Systemtic Name: trinonyl (2Z)-3-[(1E)-cycloocten-1-yl]cyclooct-2-ene-1,1,2-tricarboxylate Openeye Name: trinonyl (2Z)-3-[(1E)-cycloocten-1-yl]cyclooct-2-ene-1,1,2-tricarboxylate CAS Name: (2Z)-3-[(1E)-1-cyclooctenyl]cyclooct-2-ene-1,1,2-tricarboxylic acid trinonyl ester IUPAC Name: trinonyl (2Z)-3-[(1E)-cycloocten-1-yl]cyclooct-2-ene-1,1,2-tricarboxylate Traditional Name: (2Z)-3-[(1E)-cycloocten-1-yl]cyclooct-2-ene-1,1,2-tricarboxylic acid trinonyl ester Formula: C46H80O6 MolecularWeight: 729.1238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC(=O)C1=C(CCCCCC1(C(=O)OCCCCCCCCC)C(=O)OCCCCCCCCC)C2=CCCCCCC2

Isomeric SMILES

CCCCCCCCCOC(=O)/C/1=C(/CCCCCC1(C(=O)OCCCCCCCCC)C(=O)OCCCCCCCCC)\C\2=C\CCCCCC2

InChI

InChI=1S/C46H80O6/c1-4-7-10-13-16-22-30-37-50-43(47)42-41(40-33-26-20-19-21-27-34-40)35-28-25-29-36-46(42,44(48)51-38-31-23-17-14-11-8-5-2)45(49)52-39-32-24-18-15-12-9-6-3/h33H,4-32,34-39H2,1-3H3/b40-33+,42-41+