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N-[2-(2-diethylaminoethyloxy)-3-ethanoyl-phenyl]methanesulfonamide; methanesulfonic acid

N-[2-(2-diethylaminoethyloxy)-3-ethanoyl-phenyl]methanesulfonamide; methanesulfonic acid

Systemtic Name:N-[2-(2-diethylaminoethyloxy)-3-ethanoyl-phenyl]methanesulfonamide; methanesulfonic acid
Openeye Name:N-[3-acetyl-2-(2-diethylaminoethyloxy)phenyl]methanesulfonamide; methanesulfonic acid
CAS Name:N-[3-acetyl-2-(2-diethylaminoethyloxy)phenyl]methanesulfonamide; methanesulfonic acid
IUPAC Name:N-[3-acetyl-2-(2-diethylaminoethyloxy)phenyl]methanesulfonamide; methanesulfonic acid
Traditional Name:N-[3-acetyl-2-(2-diethylaminoethyloxy)phenyl]methanesulfonamide; mesylic acid
Formula: C16H28N2O7S2
MolecularWeight: 424.53272
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=C(C=CC=C1NS(=O)(=O)C)C(=O)C.CS(=O)(=O)O


Isomeric SMILES

CCN(CC)CCOC1=C(C=CC=C1NS(=O)(=O)C)C(=O)C.CS(=O)(=O)O


InChI

InChI=1S/C15H24N2O4S.CH4O3S/c1-5-17(6-2)10-11-21-15-13(12(3)18)8-7-9-14(15)16-22(4,19)20;1-5(2,3)4/h7-9,16H,5-6,10-11H2,1-4H3;1H3,(H,2,3,4)


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