3,5-dimethyl-1-(4-methylsulfonyl-2-nitro-phenyl)piperidine

Systemtic Name: 3,5-dimethyl-1-(4-methylsulfonyl-2-nitro-phenyl)piperidine Openeye Name: 3,5-dimethyl-1-(4-methylsulfonyl-2-nitro-phenyl)piperidine CAS Name: 3,5-dimethyl-1-(4-methylsulfonyl-2-nitrophenyl)piperidine IUPAC Name: 3,5-dimethyl-1-(4-methylsulfonyl-2-nitrophenyl)piperidine Traditional Name: 1-(4-mesyl-2-nitro-phenyl)-3,5-dimethyl-piperidine Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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