O1,O2-dimethyl O3-octadecyl but-3-ene-1,2,3-tricarboxylate

Systemtic Name: O1,O2-dimethyl O3-octadecyl but-3-ene-1,2,3-tricarboxylate Openeye Name: O1,O2-dimethyl O3-octadecyl but-3-ene-1,2,3-tricarboxylate CAS Name: 3-butene-1,2,3-tricarboxylic acid O1,O2-dimethyl ester O3-octadecyl ester IUPAC Name: 1-O,2-O-dimethyl 3-O-octadecyl but-3-ene-1,2,3-tricarboxylate Traditional Name: but-3-ene-1,2,3-tricarboxylic acid O1,O2-dimethyl ester O3-stearyl ester Formula: C27H48O6 MolecularWeight: 468.66642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C(CC(=O)OC)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C(CC(=O)OC)C(=O)OC

InChI

InChI=1S/C27H48O6/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-33-26(29)23(2)24(27(30)32-4)22-25(28)31-3/h24H,2,5-22H2,1,3-4H3