[2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 4-methoxy-3-(propan-2-ylsulfamoyl)benzoate

Systemtic Name: [2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 4-methoxy-3-(propan-2-ylsulfamoyl)benzoate Openeye Name: [2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl] 3-(isopropylsulfamoyl)-4-methoxy-benzoate CAS Name: 4-methoxy-3-(propan-2-ylsulfamoyl)benzoic acid [2-(1-ethyl-2,5-dimethyl-3-pyrrolyl)-2-oxoethyl] ester IUPAC Name: [2-(1-ethyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl] 4-methoxy-3-(propan-2-ylsulfamoyl)benzoate Traditional Name: 3-(isopropylsulfamoyl)-4-methoxy-benzoic acid [2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethyl] ester Formula: C21H28N2O6S MolecularWeight: 436.52182

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C)C(=O)COC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)NC(C)C)C

Isomeric SMILES

CCN1C(=CC(=C1C)C(=O)COC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)NC(C)C)C

InChI

InChI=1S/C21H28N2O6S/c1-7-23-14(4)10-17(15(23)5)18(24)12-29-21(25)16-8-9-19(28-6)20(11-16)30(26,27)22-13(2)3/h8-11,13,22H,7,12H2,1-6H3