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5-thiocyanatopentyl pyridine-3-carboxylate

5-thiocyanatopentyl pyridine-3-carboxylate

Systemtic Name:5-thiocyanatopentyl pyridine-3-carboxylate
Openeye Name:5-thiocyanatopentyl pyridine-3-carboxylate
CAS Name:3-pyridinecarboxylic acid 5-thiocyanatopentyl ester
IUPAC Name:5-thiocyanatopentyl pyridine-3-carboxylate
Traditional Name:nicotinic acid 5-thiocyanatopentyl ester
Formula: C12H14N2O2S
MolecularWeight: 250.31676
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)OCCCCCSC#N


Isomeric SMILES

C1=CC(=CN=C1)C(=O)OCCCCCSC#N


InChI

InChI=1S/C12H14N2O2S/c13-10-17-8-3-1-2-7-16-12(15)11-5-4-6-14-9-11/h4-6,9H,1-3,7-8H2


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