pentamethyl (7E)-3-methylidene-12-oxidanylidene-cyclotetradec-7-ene-1,1,5,5,10-pentacarboxylate

Systemtic Name: pentamethyl (7E)-3-methylidene-12-oxidanylidene-cyclotetradec-7-ene-1,1,5,5,10-pentacarboxylate Openeye Name: pentamethyl (7E)-3-methylene-12-oxo-cyclotetradec-7-ene-1,1,5,5,10-pentacarboxylate CAS Name: (7E)-3-methylene-12-oxocyclotetradec-7-ene-1,1,5,5,10-pentacarboxylic acid pentamethyl ester IUPAC Name: pentamethyl (7E)-3-methylidene-12-oxocyclotetradec-7-ene-1,1,5,5,10-pentacarboxylate Traditional Name: (7E)-12-keto-3-methylene-cyclotetradec-7-ene-1,1,5,5,10-pentacarboxylic acid pentamethyl ester Formula: C25H34O11 MolecularWeight: 510.53086

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC=CCC(CC(=C)CC(CCC(=O)C1)(C(=O)OC)C(=O)OC)(C(=O)OC)C(=O)OC

Isomeric SMILES

COC(=O)C1C/C=C/CC(CC(=C)CC(CCC(=O)C1)(C(=O)OC)C(=O)OC)(C(=O)OC)C(=O)OC

InChI

InChI=1S/C25H34O11/c1-16-14-24(20(28)33-3,21(29)34-4)11-8-7-9-17(19(27)32-2)13-18(26)10-12-25(15-16,22(30)35-5)23(31)36-6/h7-8,17H,1,9-15H2,2-6H3/b8-7+