3,5-dimethyl-1-(2-methyl-3-nitro-phenyl)sulfonyl-piperidine

Systemtic Name: 3,5-dimethyl-1-(2-methyl-3-nitro-phenyl)sulfonyl-piperidine Openeye Name: 3,5-dimethyl-1-(2-methyl-3-nitro-phenyl)sulfonyl-piperidine CAS Name: 3,5-dimethyl-1-(2-methyl-3-nitrophenyl)sulfonylpiperidine IUPAC Name: 3,5-dimethyl-1-(2-methyl-3-nitrophenyl)sulfonylpiperidine Traditional Name: 3,5-dimethyl-1-(2-methyl-3-nitro-phenyl)sulfonyl-piperidine Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2C)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2C)[N+](=O)[O-])C

InChI

InChI=1S/C14H20N2O4S/c1-10-7-11(2)9-15(8-10)21(19,20)14-6-4-5-13(12(14)3)16(17)18/h4-6,10-11H,7-9H2,1-3H3