3-pyridin-3-ylpropyl hydrogen sulfate

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCCOS(=O)(=O)O

Isomeric SMILES

C1=CC(=CN=C1)CCCOS(=O)(=O)O

InChI

InChI=1S/C8H11NO4S/c10-14(11,12)13-6-2-4-8-3-1-5-9-7-8/h1,3,5,7H,2,4,6H2,(H,10,11,12)