N-(5-chloranylpyridin-2-yl)-1-[4-(diethylsulfamoyl)-2-nitro-phenyl]piperidine-4-carboxamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-1-[4-(diethylsulfamoyl)-2-nitro-phenyl]piperidine-4-carboxamide Openeye Name: N-(5-chloro-2-pyridyl)-1-[4-(diethylsulfamoyl)-2-nitro-phenyl]piperidine-4-carboxamide CAS Name: N-(5-chloro-2-pyridinyl)-1-[4-(diethylsulfamoyl)-2-nitrophenyl]-4-piperidinecarboxamide IUPAC Name: N-(5-chloropyridin-2-yl)-1-[4-(diethylsulfamoyl)-2-nitrophenyl]piperidine-4-carboxamide Traditional Name: N-(5-chloro-2-pyridyl)-1-[4-(diethylsulfamoyl)-2-nitro-phenyl]isonipecotamide Formula: C21H26ClN5O5S MolecularWeight: 495.97964

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCC(CC2)C(=O)NC3=NC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCC(CC2)C(=O)NC3=NC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H26ClN5O5S/c1-3-26(4-2)33(31,32)17-6-7-18(19(13-17)27(29)30)25-11-9-15(10-12-25)21(28)24-20-8-5-16(22)14-23-20/h5-8,13-15H,3-4,9-12H2,1-2H3,(H,23,24,28)