methyl 2,4-dimethyl-5-[2-[3-(prop-2-ynylsulfamoyl)phenyl]carbonyloxypropanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[2-[3-(prop-2-ynylsulfamoyl)phenyl]carbonyloxypropanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-[3-(prop-2-ynylsulfamoyl)benzoyl]oxypropanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-[oxo-[3-(prop-2-ynylsulfamoyl)phenyl]methoxy]propyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-[3-(prop-2-ynylsulfamoyl)benzoyl]oxypropanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-[3-(propargylsulfamoyl)benzoyl]oxypropanoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H22N2O7S MolecularWeight: 446.47358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC#C

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC#C

InChI

InChI=1S/C21H22N2O7S/c1-6-10-22-31(27,28)16-9-7-8-15(11-16)20(25)30-14(4)19(24)18-12(2)17(13(3)23-18)21(26)29-5/h1,7-9,11,14,22-23H,10H2,2-5H3