3-pyridin-4-ylpropyl hydrogen sulfate

Systemtic Name: 3-pyridin-4-ylpropyl hydrogen sulfate Openeye Name: 3-(4-pyridyl)propyl hydrogen sulfate CAS Name: sulfuric acid 3-pyridin-4-ylpropyl ester IUPAC Name: 3-pyridin-4-ylpropyl hydrogen sulfate Traditional Name: sulfuric acid 3-(4-pyridyl)propyl ester Formula: C8H11NO4S MolecularWeight: 217.24224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CCCOS(=O)(=O)O

Isomeric SMILES

C1=CN=CC=C1CCCOS(=O)(=O)O

InChI

InChI=1S/C8H11NO4S/c10-14(11,12)13-7-1-2-8-3-5-9-6-4-8/h3-6H,1-2,7H2,(H,10,11,12)