[2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 2-[(4-ethoxyphenyl)sulfonylamino]ethanoate

Systemtic Name: [2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 2-[(4-ethoxyphenyl)sulfonylamino]ethanoate Openeye Name: [2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl] 2-[(4-ethoxyphenyl)sulfonylamino]acetate CAS Name: 2-[(4-ethoxyphenyl)sulfonylamino]acetic acid [2-(1-ethyl-2,5-dimethyl-3-pyrrolyl)-2-oxoethyl] ester IUPAC Name: [2-(1-ethyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl] 2-[(4-ethoxyphenyl)sulfonylamino]acetate Traditional Name: 2-(p-phenetylsulfonylamino)acetic acid [2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethyl] ester Formula: C20H26N2O6S MolecularWeight: 422.49524

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C)C(=O)COC(=O)CNS(=O)(=O)C2=CC=C(C=C2)OCC)C

Isomeric SMILES

CCN1C(=CC(=C1C)C(=O)COC(=O)CNS(=O)(=O)C2=CC=C(C=C2)OCC)C

InChI

InChI=1S/C20H26N2O6S/c1-5-22-14(3)11-18(15(22)4)19(23)13-28-20(24)12-21-29(25,26)17-9-7-16(8-10-17)27-6-2/h7-11,21H,5-6,12-13H2,1-4H3