(3R,4S)-1-methyl-4-(2-nitropropan-2-yl)-3-prop-2-enyl-piperidine-2-thione

Systemtic Name: (3R,4S)-1-methyl-4-(2-nitropropan-2-yl)-3-prop-2-enyl-piperidine-2-thione Openeye Name: (3R,4S)-3-allyl-1-methyl-4-(1-methyl-1-nitro-ethyl)piperidine-2-thione CAS Name: (3R,4S)-1-methyl-4-(2-nitropropan-2-yl)-3-prop-2-enyl-2-piperidinethione IUPAC Name: (3R,4S)-1-methyl-4-(2-nitropropan-2-yl)-3-prop-2-enylpiperidine-2-thione Traditional Name: (3R,4S)-3-allyl-1-methyl-4-(1-methyl-1-nitro-ethyl)piperidine-2-thione Formula: C12H20N2O2S MolecularWeight: 256.3644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CCN(C(=S)C1CC=C)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C12H20N2O2S/c1-5-6-9-10(12(2,3)14(15)16)7-8-13(4)11(9)17/h5,9-10H,1,6-8H2,2-4H3/t9-,10+/m1/s1