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methyl 16-[[4-(methylsulfonylcarbamoyl)phenyl]amino]hexadecanoate

methyl 16-[[4-(methylsulfonylcarbamoyl)phenyl]amino]hexadecanoate

Systemtic Name:methyl 16-[[4-(methylsulfonylcarbamoyl)phenyl]amino]hexadecanoate
Openeye Name:methyl 16-[4-(methylsulfonylcarbamoyl)anilino]hexadecanoate
CAS Name:16-[4-[methanesulfonamido(oxo)methyl]anilino]hexadecanoic acid methyl ester
IUPAC Name:methyl 16-[4-(methylsulfonylcarbamoyl)anilino]hexadecanoate
Traditional Name:16-[4-(mesylcarbamoyl)anilino]palmitic acid methyl ester
Formula: C25H42N2O5S
MolecularWeight: 482.67638
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)NS(=O)(=O)C


Isomeric SMILES

COC(=O)CCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)NS(=O)(=O)C


InChI

InChI=1S/C25H42N2O5S/c1-32-24(28)16-14-12-10-8-6-4-3-5-7-9-11-13-15-21-26-23-19-17-22(18-20-23)25(29)27-33(2,30)31/h17-20,26H,3-16,21H2,1-2H3,(H,27,29)


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