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methyl 2-(2-carboxyoxy-5-hexadecyl-phenyl)benzoate

methyl 2-(2-carboxyoxy-5-hexadecyl-phenyl)benzoate

Systemtic Name:methyl 2-(2-carboxyoxy-5-hexadecyl-phenyl)benzoate
Openeye Name:methyl 2-(2-carboxyoxy-5-hexadecyl-phenyl)benzoate
CAS Name:2-(2-carboxyoxy-5-hexadecylphenyl)benzoic acid methyl ester
IUPAC Name:methyl 2-(2-carboxyoxy-5-hexadecylphenyl)benzoate
Traditional Name:2-(2-carboxyoxy-5-cetyl-phenyl)benzoic acid methyl ester
Formula: C31H44O5
MolecularWeight: 496.67806
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=CC(=C(C=C1)OC(=O)O)C2=CC=CC=C2C(=O)OC


Isomeric SMILES

CCCCCCCCCCCCCCCCC1=CC(=C(C=C1)OC(=O)O)C2=CC=CC=C2C(=O)OC


InChI

InChI=1S/C31H44O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-25-22-23-29(36-31(33)34)28(24-25)26-20-17-18-21-27(26)30(32)35-2/h17-18,20-24H,3-16,19H2,1-2H3,(H,33,34)


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