phenyl nonacosanoate

Systemtic Name: phenyl nonacosanoate Openeye Name: phenyl nonacosanoate CAS Name: nonacosanoic acid phenyl ester IUPAC Name: phenyl nonacosanoate Traditional Name: nonacosanoic acid phenyl ester Formula: C35H62O2 MolecularWeight: 514.86558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC1=CC=CC=C1

InChI

InChI=1S/C35H62O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-30-33-35(36)37-34-31-28-27-29-32-34/h27-29,31-32H,2-26,30,33H2,1H3