1-(2-chloranyl-5-nitro-phenyl)sulfonyl-N-[cyclopropyl(phenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)sulfonyl-N-[cyclopropyl(phenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(2-chloro-5-nitro-phenyl)sulfonyl-N-[cyclopropyl(phenyl)methyl]piperidine-4-carboxamide CAS Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-N-[cyclopropyl(phenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-N-[cyclopropyl(phenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(2-chloro-5-nitro-phenyl)sulfonyl-N-[cyclopropyl(phenyl)methyl]isonipecotamide Formula: C22H24ClN3O5S MolecularWeight: 477.96106

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C2=CC=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CC1C(C2=CC=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H24ClN3O5S/c23-19-9-8-18(26(28)29)14-20(19)32(30,31)25-12-10-17(11-13-25)22(27)24-21(16-6-7-16)15-4-2-1-3-5-15/h1-5,8-9,14,16-17,21H,6-7,10-13H2,(H,24,27)