(phenylmethyl) 2-[2-(4-sulfamoylphenyl)ethylcarbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[2-(4-sulfamoylphenyl)ethylcarbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl 2-[2-(4-sulfamoylphenyl)ethylcarbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[oxo-[2-(4-sulfamoylphenyl)ethylamino]methyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-(4-sulfamoylphenyl)ethylcarbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[2-(4-sulfamoylphenyl)ethylcarbamoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C21H25N3O5S/c22-30(27,28)18-10-8-16(9-11-18)12-13-23-20(25)19-7-4-14-24(19)21(26)29-15-17-5-2-1-3-6-17/h1-3,5-6,8-11,19H,4,7,12-15H2,(H,23,25)(H2,22,27,28)