19-(4-methylphenyl)heptatriacontanedioic acid

Systemtic Name: 19-(4-methylphenyl)heptatriacontanedioic acid Openeye Name: 19-(p-tolyl)heptatriacontanedioic acid CAS Name: 19-(4-methylphenyl)heptatriacontanedioic acid IUPAC Name: 19-(4-methylphenyl)heptatriacontanedioic acid Traditional Name: 19-(p-tolyl)heptatriacontanedioic acid Formula: C44H78O4 MolecularWeight: 671.08772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CCCCCCCCCCCCCCCCCC(=O)O)CCCCCCCCCCCCCCCCCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(CCCCCCCCCCCCCCCCCC(=O)O)CCCCCCCCCCCCCCCCCC(=O)O

InChI

InChI=1S/C44H78O4/c1-40-36-38-42(39-37-40)41(32-28-24-20-16-12-8-4-2-6-10-14-18-22-26-30-34-43(45)46)33-29-25-21-17-13-9-5-3-7-11-15-19-23-27-31-35-44(47)48/h36-39,41H,2-35H2,1H3,(H,45,46)(H,47,48)