methyl 1-(2-nitrophenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-(2-nitrophenyl)sulfonylpiperidine-4-carboxylate Openeye Name: methyl 1-(2-nitrophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(2-nitrophenyl)sulfonyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-nitrophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-nitrophenyl)sulfonylisonipecotic acid methyl ester Formula: C13H16N2O6S MolecularWeight: 328.34094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O6S/c1-21-13(16)10-6-8-14(9-7-10)22(19,20)12-5-3-2-4-11(12)15(17)18/h2-5,10H,6-9H2,1H3