O1,O4-bis(6-methylheptyl) O2-(8-methylnonyl) benzene-1,2,4-tricarboxylate

Systemtic Name: O1,O4-bis(6-methylheptyl) O2-(8-methylnonyl) benzene-1,2,4-tricarboxylate Openeye Name: O1,O4-bis(6-methylheptyl) O2-(8-methylnonyl) benzene-1,2,4-tricarboxylate CAS Name: benzene-1,2,4-tricarboxylic acid O1,O4-bis(6-methylheptyl) ester O2-(8-methylnonyl) ester IUPAC Name: 1-O,4-O-bis(6-methylheptyl) 2-O-(8-methylnonyl) benzene-1,2,4-tricarboxylate Traditional Name: benzene-1,2,4-tricarboxylic acid O1,O4-bis(6-methylheptyl) ester O2-(8-methylnonyl) ester Formula: C35H58O6 MolecularWeight: 574.83142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCOC(=O)C1=C(C=CC(=C1)C(=O)OCCCCCC(C)C)C(=O)OCCCCCC(C)C

Isomeric SMILES

CC(C)CCCCCCCOC(=O)C1=C(C=CC(=C1)C(=O)OCCCCCC(C)C)C(=O)OCCCCCC(C)C

InChI

InChI=1S/C35H58O6/c1-27(2)18-12-8-7-9-15-24-41-35(38)32-26-30(33(36)39-23-16-10-13-19-28(3)4)21-22-31(32)34(37)40-25-17-11-14-20-29(5)6/h21-22,26-29H,7-20,23-25H2,1-6H3