(2-chloranyl-4-nitro-phenyl) 1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidine-4-carboxylate

Systemtic Name: (2-chloranyl-4-nitro-phenyl) 1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidine-4-carboxylate Openeye Name: (2-chloro-4-nitro-phenyl) 1-tetralin-6-ylsulfonylpiperidine-4-carboxylate CAS Name: 1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-4-piperidinecarboxylic acid (2-chloro-4-nitrophenyl) ester IUPAC Name: (2-chloro-4-nitrophenyl) 1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidine-4-carboxylate Traditional Name: 1-tetralin-6-ylsulfonylisonipecotic acid (2-chloro-4-nitro-phenyl) ester Formula: C22H23ClN2O6S MolecularWeight: 478.94582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)OC4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)OC4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H23ClN2O6S/c23-20-14-18(25(27)28)6-8-21(20)31-22(26)16-9-11-24(12-10-16)32(29,30)19-7-5-15-3-1-2-4-17(15)13-19/h5-8,13-14,16H,1-4,9-12H2