O1-(2,3-dimethylpentyl) O2,O4-bis(2-ethylpentyl) benzene-1,2,4-tricarboxylate

Systemtic Name: O1-(2,3-dimethylpentyl) O2,O4-bis(2-ethylpentyl) benzene-1,2,4-tricarboxylate Openeye Name: O1-(2,3-dimethylpentyl) O2,O4-bis(2-ethylpentyl) benzene-1,2,4-tricarboxylate CAS Name: benzene-1,2,4-tricarboxylic acid O1-(2,3-dimethylpentyl) ester O2,O4-bis(2-ethylpentyl) ester IUPAC Name: 1-O-(2,3-dimethylpentyl) 2-O,4-O-bis(2-ethylpentyl) benzene-1,2,4-tricarboxylate Traditional Name: benzene-1,2,4-tricarboxylic acid O1-(2,3-dimethylpentyl) ester O2,O4-bis(2-ethylpentyl) ester Formula: C30H48O6 MolecularWeight: 504.69852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)COC(=O)C1=CC(=C(C=C1)C(=O)OCC(C)C(C)CC)C(=O)OCC(CC)CCC

Isomeric SMILES

CCCC(CC)COC(=O)C1=CC(=C(C=C1)C(=O)OCC(C)C(C)CC)C(=O)OCC(CC)CCC

InChI

InChI=1S/C30H48O6/c1-8-13-23(11-4)19-35-28(31)25-15-16-26(29(32)34-18-22(7)21(6)10-3)27(17-25)30(33)36-20-24(12-5)14-9-2/h15-17,21-24H,8-14,18-20H2,1-7H3