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methyl 5-(hexylcarbamoyl)-2,4-dioctoxy-benzoate

methyl 5-(hexylcarbamoyl)-2,4-dioctoxy-benzoate

Systemtic Name:methyl 5-(hexylcarbamoyl)-2,4-dioctoxy-benzoate
Openeye Name:methyl 5-(hexylcarbamoyl)-2,4-dioctoxy-benzoate
CAS Name:5-[(hexylamino)-oxomethyl]-2,4-dioctoxybenzoic acid methyl ester
IUPAC Name:methyl 5-(hexylcarbamoyl)-2,4-dioctoxybenzoate
Traditional Name:5-(hexylcarbamoyl)-2,4-dioctoxy-benzoic acid methyl ester
Formula: C31H53NO5
MolecularWeight: 519.75622
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=C(C=C1C(=O)NCCCCCC)C(=O)OC)OCCCCCCCC


Isomeric SMILES

CCCCCCCCOC1=CC(=C(C=C1C(=O)NCCCCCC)C(=O)OC)OCCCCCCCC


InChI

InChI=1S/C31H53NO5/c1-5-8-11-14-16-19-22-36-28-25-29(37-23-20-17-15-12-9-6-2)27(31(34)35-4)24-26(28)30(33)32-21-18-13-10-7-3/h24-25H,5-23H2,1-4H3,(H,32,33)


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