ethyl 7-[methylsulfonyl-[[4-(1-oxidanylhexyl)phenyl]methyl]amino]heptanoate

Systemtic Name: ethyl 7-[methylsulfonyl-[[4-(1-oxidanylhexyl)phenyl]methyl]amino]heptanoate Openeye Name: ethyl 7-[[4-(1-hydroxyhexyl)phenyl]methyl-methylsulfonyl-amino]heptanoate CAS Name: 7-[[4-(1-hydroxyhexyl)phenyl]methyl-methylsulfonylamino]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[[4-(1-hydroxyhexyl)phenyl]methyl-methylsulfonylamino]heptanoate Traditional Name: 7-[[4-(1-hydroxyhexyl)benzyl]-mesyl-amino]enanthic acid ethyl ester Formula: C23H39NO5S MolecularWeight: 441.62446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=C(C=C1)CN(CCCCCCC(=O)OCC)S(=O)(=O)C)O

Isomeric SMILES

CCCCCC(C1=CC=C(C=C1)CN(CCCCCCC(=O)OCC)S(=O)(=O)C)O

InChI

InChI=1S/C23H39NO5S/c1-4-6-9-12-22(25)21-16-14-20(15-17-21)19-24(30(3,27)28)18-11-8-7-10-13-23(26)29-5-2/h14-17,22,25H,4-13,18-19H2,1-3H3