(3,4-dichlorophenyl)methyl 1-(4-nitrophenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (3,4-dichlorophenyl)methyl 1-(4-nitrophenyl)sulfonylpiperidine-4-carboxylate Openeye Name: (3,4-dichlorophenyl)methyl 1-(4-nitrophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-nitrophenyl)sulfonyl-4-piperidinecarboxylic acid (3,4-dichlorophenyl)methyl ester IUPAC Name: (3,4-dichlorophenyl)methyl 1-(4-nitrophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-nosylisonipecotic acid (3,4-dichlorobenzyl) ester Formula: C19H18Cl2N2O6S MolecularWeight: 473.32702

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=CC(=C(C=C2)Cl)Cl)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=CC(=C(C=C2)Cl)Cl)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18Cl2N2O6S/c20-17-6-1-13(11-18(17)21)12-29-19(24)14-7-9-22(10-8-14)30(27,28)16-4-2-15(3-5-16)23(25)26/h1-6,11,14H,7-10,12H2