methyl 7-[[3-(prop-2-ynylsulfamoyl)phenyl]carbonylamino]heptanoate

Systemtic Name: methyl 7-[[3-(prop-2-ynylsulfamoyl)phenyl]carbonylamino]heptanoate Openeye Name: methyl 7-[[3-(prop-2-ynylsulfamoyl)benzoyl]amino]heptanoate CAS Name: 7-[[oxo-[3-(prop-2-ynylsulfamoyl)phenyl]methyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[[3-(prop-2-ynylsulfamoyl)benzoyl]amino]heptanoate Traditional Name: 7-[[3-(propargylsulfamoyl)benzoyl]amino]enanthic acid methyl ester Formula: C18H24N2O5S MolecularWeight: 380.45856

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC#C

Isomeric SMILES

COC(=O)CCCCCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC#C

InChI

InChI=1S/C18H24N2O5S/c1-3-12-20-26(23,24)16-10-8-9-15(14-16)18(22)19-13-7-5-4-6-11-17(21)25-2/h1,8-10,14,20H,4-7,11-13H2,2H3,(H,19,22)