(7-methoxy-2,3-dihydro-1-benzofuran-2-yl)methyl 4-methylbenzenesulfonate

Systemtic Name: (7-methoxy-2,3-dihydro-1-benzofuran-2-yl)methyl 4-methylbenzenesulfonate Openeye Name: (7-methoxy-2,3-dihydrobenzofuran-2-yl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (7-methoxy-2,3-dihydrobenzofuran-2-yl)methyl ester IUPAC Name: (7-methoxy-2,3-dihydro-1-benzofuran-2-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (7-methoxycoumaran-2-yl)methyl ester Formula: C17H18O5S MolecularWeight: 334.38682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CC3=C(O2)C(=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2CC3=C(O2)C(=CC=C3)OC

InChI

InChI=1S/C17H18O5S/c1-12-6-8-15(9-7-12)23(18,19)21-11-14-10-13-4-3-5-16(20-2)17(13)22-14/h3-9,14H,10-11H2,1-2H3