2-nonylphenol; tridecyl octadecanoate

Systemtic Name: 2-nonylphenol; tridecyl octadecanoate Openeye Name: 2-nonylphenol; tridecyl octadecanoate CAS Name: 2-nonylphenol; octadecanoic acid tridecyl ester IUPAC Name: 2-nonylphenol; tridecyl octadecanoate Traditional Name: 2-nonylphenol; stearic acid tridecyl ester Formula: C46H86O3 MolecularWeight: 687.17324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCC.CCCCCCCCCC1=CC=CC=C1O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCC.CCCCCCCCCC1=CC=CC=C1O

InChI

InChI=1S/C31H62O2.C15H24O/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-25-27-29-31(32)33-30-28-26-24-22-20-14-12-10-8-6-4-2;1-2-3-4-5-6-7-8-11-14-12-9-10-13-15(14)16/h3-30H2,1-2H3;9-10,12-13,16H,2-8,11H2,1H3