2-tetracontan-2-ylphenol

Systemtic Name: 2-tetracontan-2-ylphenol Openeye Name: 2-(1-methylnonatriacontyl)phenol CAS Name: 2-tetracontan-2-ylphenol IUPAC Name: 2-tetracontan-2-ylphenol Traditional Name: 2-(1-methylnonatriacontyl)phenol Formula: C46H86O MolecularWeight: 655.17444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C1=CC=CC=C1O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C1=CC=CC=C1O

InChI

InChI=1S/C46H86O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-41-44(2)45-42-39-40-43-46(45)47/h39-40,42-44,47H,3-38,41H2,1-2H3