(2-nitro-1-phenyl-ethyl) piperidine-1-carbodithioate

Systemtic Name: (2-nitro-1-phenyl-ethyl) piperidine-1-carbodithioate Openeye Name: (2-nitro-1-phenyl-ethyl) piperidine-1-carbodithioate CAS Name: 1-piperidinecarbodithioic acid (2-nitro-1-phenylethyl) ester IUPAC Name: (2-nitro-1-phenylethyl) piperidine-1-carbodithioate Traditional Name: piperidine-1-carbodithioic acid (2-nitro-1-phenyl-ethyl) ester Formula: C14H18N2O2S2 MolecularWeight: 310.43492

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=S)SC(C[N+](=O)[O-])C2=CC=CC=C2

Isomeric SMILES

C1CCN(CC1)C(=S)SC(C[N+](=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C14H18N2O2S2/c17-16(18)11-13(12-7-3-1-4-8-12)20-14(19)15-9-5-2-6-10-15/h1,3-4,7-8,13H,2,5-6,9-11H2