[2-oxidanylidene-2-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl] 2-azanyl-5-oxidanyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl] 2-azanyl-5-oxidanyl-benzoate Openeye Name: [2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl] 2-amino-5-hydroxy-benzoate CAS Name: 2-amino-5-hydroxybenzoic acid [2-oxo-2-[4-(1-pyrrolidinylsulfonyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl] 2-amino-5-hydroxybenzoate Traditional Name: 2-amino-5-hydroxy-benzoic acid [2-keto-2-(4-pyrrolidinosulfonylanilino)ethyl] ester Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC(=O)C3=C(C=CC(=C3)O)N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC(=O)C3=C(C=CC(=C3)O)N

InChI

InChI=1S/C19H21N3O6S/c20-17-8-5-14(23)11-16(17)19(25)28-12-18(24)21-13-3-6-15(7-4-13)29(26,27)22-9-1-2-10-22/h3-8,11,23H,1-2,9-10,12,20H2,(H,21,24)