ethyl 1-[(3-nitrophenyl)methylsulfonyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(3-nitrophenyl)methylsulfonyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(3-nitrophenyl)methylsulfonyl]piperidine-4-carboxylate CAS Name: 1-[(3-nitrophenyl)methylsulfonyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(3-nitrophenyl)methylsulfonyl]piperidine-4-carboxylate Traditional Name: 1-(3-nitrobenzyl)sulfonylisonipecotic acid ethyl ester Formula: C15H20N2O6S MolecularWeight: 356.3941

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O6S/c1-2-23-15(18)13-6-8-16(9-7-13)24(21,22)11-12-4-3-5-14(10-12)17(19)20/h3-5,10,13H,2,6-9,11H2,1H3