4-[5-(2,4-dichlorophenyl)-1-(2-nitrophenyl)sulfonyl-pyrazol-3-yl]piperidine

Systemtic Name: 4-[5-(2,4-dichlorophenyl)-1-(2-nitrophenyl)sulfonyl-pyrazol-3-yl]piperidine Openeye Name: 4-[5-(2,4-dichlorophenyl)-1-(2-nitrophenyl)sulfonyl-pyrazol-3-yl]piperidine CAS Name: 4-[5-(2,4-dichlorophenyl)-1-(2-nitrophenyl)sulfonyl-3-pyrazolyl]piperidine IUPAC Name: 4-[5-(2,4-dichlorophenyl)-1-(2-nitrophenyl)sulfonylpyrazol-3-yl]piperidine Traditional Name: 4-[5-(2,4-dichlorophenyl)-1-(2-nitrophenyl)sulfonyl-pyrazol-3-yl]piperidine Formula: C20H18Cl2N4O4S MolecularWeight: 481.35232

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=NN(C(=C2)C3=C(C=C(C=C3)Cl)Cl)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CNCCC1C2=NN(C(=C2)C3=C(C=C(C=C3)Cl)Cl)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C20H18Cl2N4O4S/c21-14-5-6-15(16(22)11-14)19-12-17(13-7-9-23-10-8-13)24-25(19)31(29,30)20-4-2-1-3-18(20)26(27)28/h1-6,11-13,23H,7-10H2