trioctan-2-yl (E)-prop-1-ene-1,2,3-tricarboxylate

Systemtic Name: trioctan-2-yl (E)-prop-1-ene-1,2,3-tricarboxylate Openeye Name: tris(1-methylheptyl) (E)-prop-1-ene-1,2,3-tricarboxylate CAS Name: (E)-1-propene-1,2,3-tricarboxylic acid trioctan-2-yl ester IUPAC Name: trioctan-2-yl (E)-prop-1-ene-1,2,3-tricarboxylate Traditional Name: (E)-prop-1-ene-1,2,3-tricarboxylic acid tris(1-methylheptyl) ester Formula: C30H54O6 MolecularWeight: 510.74616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)CC(=CC(=O)OC(C)CCCCCC)C(=O)OC(C)CCCCCC

Isomeric SMILES

CCCCCCC(C)OC(=O)C/C(=C\C(=O)OC(C)CCCCCC)/C(=O)OC(C)CCCCCC

InChI

InChI=1S/C30H54O6/c1-7-10-13-16-19-24(4)34-28(31)22-27(30(33)36-26(6)21-18-15-12-9-3)23-29(32)35-25(5)20-17-14-11-8-2/h22,24-26H,7-21,23H2,1-6H3/b27-22+