(2S)-2-methyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine

Systemtic Name: (2S)-2-methyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine Openeye Name: (2S)-2-methyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine CAS Name: (2S)-2-methyl-1-(2-methyl-5-nitrophenyl)sulfonylpiperidine IUPAC Name: (2S)-2-methyl-1-(2-methyl-5-nitrophenyl)sulfonylpiperidine Traditional Name: (2S)-2-methyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])C

Isomeric SMILES

C[C@H]1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])C

InChI

InChI=1S/C13H18N2O4S/c1-10-6-7-12(15(16)17)9-13(10)20(18,19)14-8-4-3-5-11(14)2/h6-7,9,11H,3-5,8H2,1-2H3/t11-/m0/s1