(2-deuterio-1,3-dihydroinden-2-yl) 4-methylbenzenesulfonate

Systemtic Name: (2-deuterio-1,3-dihydroinden-2-yl) 4-methylbenzenesulfonate Openeye Name: (2-deuterioindan-2-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-deuterio-1,3-dihydroinden-2-yl) ester IUPAC Name: (2-deuterio-1,3-dihydroinden-2-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-deuterioindan-2-yl) ester Formula: C16H16O3S MolecularWeight: 289.367602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC3=CC=CC=C3C2

Isomeric SMILES

[2H]C1(CC2=CC=CC=C2C1)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C16H16O3S/c1-12-6-8-16(9-7-12)20(17,18)19-15-10-13-4-2-3-5-14(13)11-15/h2-9,15H,10-11H2,1H3/i15D