[(1S)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl] 2-methyl-5-sulfamoyl-benzoate

Systemtic Name: [(1S)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl] 2-methyl-5-sulfamoyl-benzoate Openeye Name: [(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-yl-ethyl] 2-methyl-5-sulfamoyl-benzoate CAS Name: 2-methyl-5-sulfamoylbenzoic acid [(1S)-2-oxo-1-phenyl-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: [(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl] 2-methyl-5-sulfamoylbenzoate Traditional Name: 2-methyl-5-sulfamoyl-benzoic acid [(1S)-2-keto-1-phenyl-2-pyrrolidino-ethyl] ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)OC(C2=CC=CC=C2)C(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)O[C@@H](C2=CC=CC=C2)C(=O)N3CCCC3

InChI

InChI=1S/C20H22N2O5S/c1-14-9-10-16(28(21,25)26)13-17(14)20(24)27-18(15-7-3-2-4-8-15)19(23)22-11-5-6-12-22/h2-4,7-10,13,18H,5-6,11-12H2,1H3,(H2,21,25,26)/t18-/m0/s1