(2-oxidanylidene-2-piperidin-1-yl-ethyl) 5-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-2-oxidanyl-benzoate

Systemtic Name: (2-oxidanylidene-2-piperidin-1-yl-ethyl) 5-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-2-oxidanyl-benzoate Openeye Name: [2-oxo-2-(1-piperidyl)ethyl] 5-[(4-chloro-3-nitro-phenyl)sulfonylamino]-2-hydroxy-benzoate CAS Name: 5-[(4-chloro-3-nitrophenyl)sulfonylamino]-2-hydroxybenzoic acid [2-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-1-ylethyl) 5-[(4-chloro-3-nitrophenyl)sulfonylamino]-2-hydroxybenzoate Traditional Name: 5-[(4-chloro-3-nitro-phenyl)sulfonylamino]-2-hydroxy-benzoic acid (2-keto-2-piperidino-ethyl) ester Formula: C20H20ClN3O8S MolecularWeight: 497.9061

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)COC(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])O

Isomeric SMILES

C1CCN(CC1)C(=O)COC(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])O

InChI

InChI=1S/C20H20ClN3O8S/c21-16-6-5-14(11-17(16)24(28)29)33(30,31)22-13-4-7-18(25)15(10-13)20(27)32-12-19(26)23-8-2-1-3-9-23/h4-7,10-11,22,25H,1-3,8-9,12H2