(2-oxidanyl-3-oxidanylidene-1H-inden-2-yl)methyl 4-methylbenzenesulfonate

Systemtic Name: (2-oxidanyl-3-oxidanylidene-1H-inden-2-yl)methyl 4-methylbenzenesulfonate Openeye Name: (2-hydroxy-1-oxo-indan-2-yl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-hydroxy-3-oxo-1H-inden-2-yl)methyl ester IUPAC Name: (2-hydroxy-3-oxo-1H-inden-2-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-hydroxy-1-keto-indan-2-yl)methyl ester Formula: C17H16O5S MolecularWeight: 332.37094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2(CC3=CC=CC=C3C2=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2(CC3=CC=CC=C3C2=O)O

InChI

InChI=1S/C17H16O5S/c1-12-6-8-14(9-7-12)23(20,21)22-11-17(19)10-13-4-2-3-5-15(13)16(17)18/h2-9,19H,10-11H2,1H3