(7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-(prop-2-ynylsulfamoyl)benzoate

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-(prop-2-ynylsulfamoyl)benzoate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 3-(prop-2-ynylsulfamoyl)benzoate CAS Name: 3-(prop-2-ynylsulfamoyl)benzoic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 3-(prop-2-ynylsulfamoyl)benzoate Traditional Name: 3-(propargylsulfamoyl)benzoic acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C21H17NO6S MolecularWeight: 411.42778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=CC=C3)S(=O)(=O)NCC#C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=CC=C3)S(=O)(=O)NCC#C

InChI

InChI=1S/C21H17NO6S/c1-3-9-22-29(25,26)17-6-4-5-15(11-17)21(24)27-13-16-12-20(23)28-19-10-14(2)7-8-18(16)19/h1,4-8,10-12,22H,9,13H2,2H3