(4S,6S)-6-butyl-4-(2-nitropropan-2-yl)piperidine-2-thione

Systemtic Name: (4S,6S)-6-butyl-4-(2-nitropropan-2-yl)piperidine-2-thione Openeye Name: (4S,6S)-6-butyl-4-(1-methyl-1-nitro-ethyl)piperidine-2-thione CAS Name: (4S,6S)-6-butyl-4-(2-nitropropan-2-yl)-2-piperidinethione IUPAC Name: (4S,6S)-6-butyl-4-(2-nitropropan-2-yl)piperidine-2-thione Traditional Name: (4S,6S)-6-butyl-4-(1-methyl-1-nitro-ethyl)piperidine-2-thione Formula: C12H22N2O2S MolecularWeight: 258.38028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC(CC(=S)N1)C(C)(C)[N+](=O)[O-]

Isomeric SMILES

CCCC[C@H]1C[C@@H](CC(=S)N1)C(C)(C)[N+](=O)[O-]

InChI

InChI=1S/C12H22N2O2S/c1-4-5-6-10-7-9(8-11(17)13-10)12(2,3)14(15)16/h9-10H,4-8H2,1-3H3,(H,13,17)/t9-,10-/m0/s1