(4-nitrophenyl) 2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: (4-nitrophenyl) 2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: (4-nitrophenyl) 2-chloro-5-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 2-chloro-5-(1-pyrrolidinylsulfonyl)benzoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-chloro-5-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-pyrrolidinosulfonyl-benzoic acid (4-nitrophenyl) ester Formula: C17H15ClN2O6S MolecularWeight: 410.8288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15ClN2O6S/c18-16-8-7-14(27(24,25)19-9-1-2-10-19)11-15(16)17(21)26-13-5-3-12(4-6-13)20(22)23/h3-8,11H,1-2,9-10H2