phenyl 2-[oxidanyl(phenyl)methyl]octanoate

Systemtic Name: phenyl 2-[oxidanyl(phenyl)methyl]octanoate Openeye Name: phenyl 2-[hydroxy(phenyl)methyl]octanoate CAS Name: 2-[hydroxy(phenyl)methyl]octanoic acid phenyl ester IUPAC Name: phenyl 2-[hydroxy(phenyl)methyl]octanoate Traditional Name: 2-[hydroxy(phenyl)methyl]caprylic acid phenyl ester Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(C1=CC=CC=C1)O)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CCCCCCC(C(C1=CC=CC=C1)O)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C21H26O3/c1-2-3-4-11-16-19(20(22)17-12-7-5-8-13-17)21(23)24-18-14-9-6-10-15-18/h5-10,12-15,19-20,22H,2-4,11,16H2,1H3