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[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)hexanoate

[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)hexanoate

Systemtic Name:[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)hexanoate
Openeye Name:[2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl] 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)hexanoate
CAS Name:6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)hexanoic acid [2-(2-ethyl-6-methylanilino)-2-oxoethyl] ester
IUPAC Name:[2-(2-ethyl-6-methylanilino)-2-oxoethyl] 6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)hexanoate
Traditional Name:6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)hexanoic acid [2-(2-ethyl-6-methyl-anilino)-2-keto-ethyl] ester
Formula: C25H32N2O7S
MolecularWeight: 504.59578
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)COC(=O)CCCCCNS(=O)(=O)C2=CC3=C(C=C2)OCCO3)C


Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)COC(=O)CCCCCNS(=O)(=O)C2=CC3=C(C=C2)OCCO3)C


InChI

InChI=1S/C25H32N2O7S/c1-3-19-9-7-8-18(2)25(19)27-23(28)17-34-24(29)10-5-4-6-13-26-35(30,31)20-11-12-21-22(16-20)33-15-14-32-21/h7-9,11-12,16,26H,3-6,10,13-15,17H2,1-2H3,(H,27,28)


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