ethyl 7-[[4-acetyloxy-5-(4-fluoranylphenoxy)pent-2-ynyl]-methylsulfonyl-amino]heptanoate

Systemtic Name: ethyl 7-[[4-acetyloxy-5-(4-fluoranylphenoxy)pent-2-ynyl]-methylsulfonyl-amino]heptanoate Openeye Name: ethyl 7-[[4-acetoxy-5-(4-fluorophenoxy)pent-2-ynyl]-methylsulfonyl-amino]heptanoate CAS Name: 7-[[4-acetyloxy-5-(4-fluorophenoxy)pent-2-ynyl]-methylsulfonylamino]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[[4-acetyloxy-5-(4-fluorophenoxy)pent-2-ynyl]-methylsulfonylamino]heptanoate Traditional Name: 7-[[4-acetoxy-5-(4-fluorophenoxy)pent-2-ynyl]-mesyl-amino]enanthic acid ethyl ester Formula: C23H32FNO7S MolecularWeight: 485.566083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCN(CC#CC(COC1=CC=C(C=C1)F)OC(=O)C)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)CCCCCCN(CC#CC(COC1=CC=C(C=C1)F)OC(=O)C)S(=O)(=O)C

InChI

InChI=1S/C23H32FNO7S/c1-4-30-23(27)11-7-5-6-8-16-25(33(3,28)29)17-9-10-22(32-19(2)26)18-31-21-14-12-20(24)13-15-21/h12-15,22H,4-8,11,16-18H2,1-3H3