3-methylsulfonyl-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; 1-(propan-2-ylamino)propan-2-ol

Systemtic Name: 3-methylsulfonyl-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; 1-(propan-2-ylamino)propan-2-ol Openeye Name: 1-(isopropylamino)propan-2-ol; 3-methylsulfonyl-7-oxabicyclo[2.2.1]hepta-1,3,5-triene CAS Name: 3-methylsulfonyl-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; 1-(propan-2-ylamino)-2-propanol IUPAC Name: 3-methylsulfonyl-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; 1-(propan-2-ylamino)propan-2-ol Traditional Name: 1-(isopropylamino)propan-2-ol; 3-mesyl-7-oxabicyclo[2.2.1]hepta-1,3,5-triene Formula: C13H21NO4S MolecularWeight: 287.37514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(C)O.CS(=O)(=O)C1=C2C=CC(=C1)O2

Isomeric SMILES

CC(C)NCC(C)O.CS(=O)(=O)C1=C2C=CC(=C1)O2

InChI

InChI=1S/C7H6O3S.C6H15NO/c1-11(8,9)7-4-5-2-3-6(7)10-5;1-5(2)7-4-6(3)8/h2-4H,1H3;5-8H,4H2,1-3H3