phenacyl 1-(4-nitrophenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: phenacyl 1-(4-nitrophenyl)sulfonylpiperidine-4-carboxylate Openeye Name: phenacyl 1-(4-nitrophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-nitrophenyl)sulfonyl-4-piperidinecarboxylic acid phenacyl ester IUPAC Name: phenacyl 1-(4-nitrophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-nosylisonipecotic acid phenacyl ester Formula: C20H20N2O7S MolecularWeight: 432.447

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O7S/c23-19(15-4-2-1-3-5-15)14-29-20(24)16-10-12-21(13-11-16)30(27,28)18-8-6-17(7-9-18)22(25)26/h1-9,16H,10-14H2