2,3-dihydro-1-benzofuran-2-ylmethyl 4-methylbenzenesulfonate

Systemtic Name: 2,3-dihydro-1-benzofuran-2-ylmethyl 4-methylbenzenesulfonate Openeye Name: 2,3-dihydrobenzofuran-2-ylmethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2,3-dihydrobenzofuran-2-ylmethyl ester IUPAC Name: 2,3-dihydro-1-benzofuran-2-ylmethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid coumaran-2-ylmethyl ester Formula: C16H16O4S MolecularWeight: 304.36084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CC3=CC=CC=C3O2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2CC3=CC=CC=C3O2

InChI

InChI=1S/C16H16O4S/c1-12-6-8-15(9-7-12)21(17,18)19-11-14-10-13-4-2-3-5-16(13)20-14/h2-9,14H,10-11H2,1H3