3-(3,4-dihydro-1H-isochromen-1-yl)propyl methanesulfonate

Systemtic Name: 3-(3,4-dihydro-1H-isochromen-1-yl)propyl methanesulfonate Openeye Name: 3-isochroman-1-ylpropyl methanesulfonate CAS Name: methanesulfonic acid 3-(3,4-dihydro-1H-2-benzopyran-1-yl)propyl ester IUPAC Name: 3-(3,4-dihydro-1H-isochromen-1-yl)propyl methanesulfonate Traditional Name: methanesulfonic acid 3-isochroman-1-ylpropyl ester Formula: C13H18O4S MolecularWeight: 270.34462

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCCC1C2=CC=CC=C2CCO1

Isomeric SMILES

CS(=O)(=O)OCCCC1C2=CC=CC=C2CCO1

InChI

InChI=1S/C13H18O4S/c1-18(14,15)17-9-4-7-13-12-6-3-2-5-11(12)8-10-16-13/h2-3,5-6,13H,4,7-10H2,1H3