[(3S)-3-methylpiperidin-1-yl]-(4-nitrophenyl)methanethione

Systemtic Name: [(3S)-3-methylpiperidin-1-yl]-(4-nitrophenyl)methanethione Openeye Name: [(3S)-3-methyl-1-piperidyl]-(4-nitrophenyl)methanethione CAS Name: [(3S)-3-methyl-1-piperidinyl]-(4-nitrophenyl)methanethione IUPAC Name: [(3S)-3-methylpiperidin-1-yl]-(4-nitrophenyl)methanethione Traditional Name: [(3S)-3-methylpiperidino]-(4-nitrophenyl)methanethione Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=S)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)C(=S)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O2S/c1-10-3-2-8-14(9-10)13(18)11-4-6-12(7-5-11)15(16)17/h4-7,10H,2-3,8-9H2,1H3/t10-/m0/s1