[2-[2,5-dimethyl-1-(4-sulfamoylphenyl)pyrrol-3-yl]-2-oxidanylidene-ethyl] propanoate

Systemtic Name: [2-[2,5-dimethyl-1-(4-sulfamoylphenyl)pyrrol-3-yl]-2-oxidanylidene-ethyl] propanoate Openeye Name: [2-[2,5-dimethyl-1-(4-sulfamoylphenyl)pyrrol-3-yl]-2-oxo-ethyl] propanoate CAS Name: propanoic acid [2-[2,5-dimethyl-1-(4-sulfamoylphenyl)-3-pyrrolyl]-2-oxoethyl] ester IUPAC Name: [2-[2,5-dimethyl-1-(4-sulfamoylphenyl)pyrrol-3-yl]-2-oxoethyl] propanoate Traditional Name: propionic acid [2-[2,5-dimethyl-1-(4-sulfamoylphenyl)pyrrol-3-yl]-2-keto-ethyl] ester Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCC(=O)C1=C(N(C(=C1)C)C2=CC=C(C=C2)S(=O)(=O)N)C

Isomeric SMILES

CCC(=O)OCC(=O)C1=C(N(C(=C1)C)C2=CC=C(C=C2)S(=O)(=O)N)C

InChI

InChI=1S/C17H20N2O5S/c1-4-17(21)24-10-16(20)15-9-11(2)19(12(15)3)13-5-7-14(8-6-13)25(18,22)23/h5-9H,4,10H2,1-3H3,(H2,18,22,23)