3-(2-methyl-2H-1,3-benzoselenazol-3-yl)propyl hydrogen sulfate

Systemtic Name: 3-(2-methyl-2H-1,3-benzoselenazol-3-yl)propyl hydrogen sulfate Openeye Name: 3-(2-methyl-2H-1,3-benzoselenazol-3-yl)propyl hydrogen sulfate CAS Name: sulfuric acid 3-(2-methyl-2H-1,3-benzoselenazol-3-yl)propyl ester IUPAC Name: 3-(2-methyl-2H-1,3-benzoselenazol-3-yl)propyl hydrogen sulfate Traditional Name: sulfuric acid 3-(2-methyl-2H-1,3-benzoselenazol-3-yl)propyl ester Formula: C11H15NO4SSe MolecularWeight: 336.2661

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Descriptors Computed from Structure

Canonical SMILES:

CC1N(C2=CC=CC=C2[Se]1)CCCOS(=O)(=O)O

Isomeric SMILES

CC1N(C2=CC=CC=C2[Se]1)CCCOS(=O)(=O)O

InChI

InChI=1S/C11H15NO4SSe/c1-9-12(7-4-8-16-17(13,14)15)10-5-2-3-6-11(10)18-9/h2-3,5-6,9H,4,7-8H2,1H3,(H,13,14,15)