(2-chloranyl-4-nitro-phenyl) 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (2-chloranyl-4-nitro-phenyl) 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (2-chloro-4-nitro-phenyl) 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid (2-chloro-4-nitrophenyl) ester IUPAC Name: (2-chloro-4-nitrophenyl) 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid (2-chloro-4-nitro-phenyl) ester Formula: C17H15ClN2O6S MolecularWeight: 410.8288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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