3-piperidin-1-ylpropyl (1E)-2-chloranyl-N-oxidanyl-benzenecarboximidothioate chloride

Systemtic Name: 3-piperidin-1-ylpropyl (1E)-2-chloranyl-N-oxidanyl-benzenecarboximidothioate chloride Openeye Name: 3-(1-piperidyl)propyl (1E)-2-chloro-N-hydroxy-benzenecarboximidothioate chloride CAS Name: (1E)-2-chloro-N-hydroxybenzenecarboximidothioic acid 3-(1-piperidinyl)propyl ester chloride IUPAC Name: 3-piperidin-1-ylpropyl (1E)-2-chloro-N-hydroxybenzenecarboximidothioate chloride Traditional Name: (1E)-2-chloro-N-hydroxy-benzenecarboximidothioic acid 3-piperidinopropyl ester chloride Formula: C15H21Cl2N2OS- MolecularWeight: 348.31104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCSC(=NO)C2=CC=CC=C2Cl.[Cl-]

Isomeric SMILES

C1CCN(CC1)CCCS/C(=N/O)/C2=CC=CC=C2Cl.[Cl-]

InChI

InChI=1S/C15H21ClN2OS.ClH/c16-14-8-3-2-7-13(14)15(17-19)20-12-6-11-18-9-4-1-5-10-18;/h2-3,7-8,19H,1,4-6,9-12H2;1H/p-1/b17-15+;