3,4,5,6-tetrahydro-2H-azepin-7-yl hydrogen sulfate

Systemtic Name: 3,4,5,6-tetrahydro-2H-azepin-7-yl hydrogen sulfate Openeye Name: 3,4,5,6-tetrahydro-2H-azepin-7-yl hydrogen sulfate CAS Name: sulfuric acid 3,4,5,6-tetrahydro-2H-azepin-7-yl ester IUPAC Name: 3,4,5,6-tetrahydro-2H-azepin-7-yl hydrogen sulfate Traditional Name: sulfuric acid 3,4,5,6-tetrahydro-2H-azepin-7-yl ester Formula: C6H11NO4S MolecularWeight: 193.22084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NCC1)OS(=O)(=O)O

Isomeric SMILES

C1CCC(=NCC1)OS(=O)(=O)O

InChI

InChI=1S/C6H11NO4S/c8-12(9,10)11-6-4-2-1-3-5-7-6/h1-5H2,(H,8,9,10)