1-[2,5-bis(chloranyl)phenyl]sulfonyl-N-(2-methyl-3-nitro-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-[2,5-bis(chloranyl)phenyl]sulfonyl-N-(2-methyl-3-nitro-phenyl)piperidine-4-carboxamide Openeye Name: 1-(2,5-dichlorophenyl)sulfonyl-N-(2-methyl-3-nitro-phenyl)piperidine-4-carboxamide CAS Name: 1-(2,5-dichlorophenyl)sulfonyl-N-(2-methyl-3-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: 1-(2,5-dichlorophenyl)sulfonyl-N-(2-methyl-3-nitrophenyl)piperidine-4-carboxamide Traditional Name: 1-(2,5-dichlorophenyl)sulfonyl-N-(2-methyl-3-nitro-phenyl)isonipecotamide Formula: C19H19Cl2N3O5S MolecularWeight: 472.34226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C19H19Cl2N3O5S/c1-12-16(3-2-4-17(12)24(26)27)22-19(25)13-7-9-23(10-8-13)30(28,29)18-11-14(20)5-6-15(18)21/h2-6,11,13H,7-10H2,1H3,(H,22,25)