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

Systemtic Name: (7-chloranyl-2,3-dihydro-1-benzofuran-2-yl)methyl 4-methylbenzenesulfonate Openeye Name: (7-chloro-2,3-dihydrobenzofuran-2-yl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (7-chloro-2,3-dihydrobenzofuran-2-yl)methyl ester IUPAC Name: (7-chloro-2,3-dihydro-1-benzofuran-2-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (7-chlorocoumaran-2-yl)methyl ester Formula: C16H15ClO4S MolecularWeight: 338.8059

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15ClO4S/c1-11-5-7-14(8-6-11)22(18,19)20-10-13-9-12-3-2-4-15(17)16(12)21-13/h2-8,13H,9-10H2,1H3