O1-[(5S)-5-butyl-8-methyl-nonyl] O6-[(4S)-4-[(2R)-2-methylbutyl]nonyl] hexanedioate

Systemtic Name: O1-[(5S)-5-butyl-8-methyl-nonyl] O6-[(4S)-4-[(2R)-2-methylbutyl]nonyl] hexanedioate Openeye Name: O1-[(5S)-5-butyl-8-methyl-nonyl] O6-[(4S)-4-[(2R)-2-methylbutyl]nonyl] hexanedioate CAS Name: hexanedioic acid O1-[(5S)-5-butyl-8-methylnonyl] ester O6-[(4S)-4-[(2R)-2-methylbutyl]nonyl] ester IUPAC Name: 1-O-[(5S)-5-butyl-8-methylnonyl] 6-O-[(4S)-4-[(2R)-2-methylbutyl]nonyl] hexanedioate Traditional Name: adipic acid O1-[(5S)-5-butyl-8-methyl-nonyl] ester O6-[(4S)-4-[(2R)-2-methylbutyl]nonyl] ester Formula: C34H66O4 MolecularWeight: 538.88544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCOC(=O)CCCCC(=O)OCCCCC(CCCC)CCC(C)C)CC(C)CC

Isomeric SMILES

CCCCC[C@@H](CCCOC(=O)CCCCC(=O)OCCCC[C@H](CCCC)CCC(C)C)C[C@H](C)CC

InChI

InChI=1S/C34H66O4/c1-7-10-12-20-32(28-30(6)9-3)21-17-27-38-34(36)23-14-13-22-33(35)37-26-16-15-19-31(18-11-8-2)25-24-29(4)5/h29-32H,7-28H2,1-6H3/t30-,31+,32+/m1/s1