N-(2-methoxy-5-nitro-phenyl)-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(4-isopropylphenyl)sulfonyl-N-(2-methoxy-5-nitro-phenyl)piperidine-4-carboxamide CAS Name: N-(2-methoxy-5-nitrophenyl)-1-(4-propan-2-ylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-1-p-cumenylsulfonyl-isonipecotamide Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O6S/c1-15(2)16-4-7-19(8-5-16)32(29,30)24-12-10-17(11-13-24)22(26)23-20-14-18(25(27)28)6-9-21(20)31-3/h4-9,14-15,17H,10-13H2,1-3H3,(H,23,26)