(2R)-1-(2-methyl-5-nitro-phenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: (2R)-1-(2-methyl-5-nitro-phenyl)sulfonylpiperidine-2-carboxylate Openeye Name: (2R)-1-(2-methyl-5-nitro-phenyl)sulfonylpiperidine-2-carboxylate CAS Name: (2R)-1-(2-methyl-5-nitrophenyl)sulfonyl-2-piperidinecarboxylate IUPAC Name: (2R)-1-(2-methyl-5-nitrophenyl)sulfonylpiperidine-2-carboxylate Traditional Name: (2R)-1-(2-methyl-5-nitro-phenyl)sulfonylpipecolinate Formula: C13H15N2O6S- MolecularWeight: 327.333

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCCCC2C(=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCCC[C@@H]2C(=O)[O-]

InChI

InChI=1S/C13H16N2O6S/c1-9-5-6-10(15(18)19)8-12(9)22(20,21)14-7-3-2-4-11(14)13(16)17/h5-6,8,11H,2-4,7H2,1H3,(H,16,17)/p-1/t11-/m1/s1