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

Systemtic Name: (7-propan-2-yl-2,3-dihydro-1-benzofuran-2-yl)methyl 4-methylbenzenesulfonate Openeye Name: (7-isopropyl-2,3-dihydrobenzofuran-2-yl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (7-propan-2-yl-2,3-dihydrobenzofuran-2-yl)methyl ester IUPAC Name: (7-propan-2-yl-2,3-dihydro-1-benzofuran-2-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (7-isopropylcoumaran-2-yl)methyl ester Formula: C19H22O4S MolecularWeight: 346.44058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22O4S/c1-13(2)18-6-4-5-15-11-16(23-19(15)18)12-22-24(20,21)17-9-7-14(3)8-10-17/h4-10,13,16H,11-12H2,1-3H3