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1-(4-phenylmethoxyphenyl)ethyl nonacosanoate

1-(4-phenylmethoxyphenyl)ethyl nonacosanoate

Systemtic Name:1-(4-phenylmethoxyphenyl)ethyl nonacosanoate
Openeye Name:1-(4-benzyloxyphenyl)ethyl nonacosanoate
CAS Name:nonacosanoic acid 1-(4-phenylmethoxyphenyl)ethyl ester
IUPAC Name:1-(4-phenylmethoxyphenyl)ethyl nonacosanoate
Traditional Name:nonacosanoic acid 1-(4-benzoxyphenyl)ethyl ester
Formula: C44H72O3
MolecularWeight: 649.04068
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC(C)C1=CC=C(C=C1)OCC2=CC=CC=C2


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC(C)C1=CC=C(C=C1)OCC2=CC=CC=C2


InChI

InChI=1S/C44H72O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-31-34-44(45)47-40(2)42-35-37-43(38-36-42)46-39-41-32-29-28-30-33-41/h28-30,32-33,35-38,40H,3-27,31,34,39H2,1-2H3


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