(1,7-dimethyl-3-oxidanylidene-1,2-dihydroinden-4-yl) (E)-2-phenylethenesulfonate

Systemtic Name: (1,7-dimethyl-3-oxidanylidene-1,2-dihydroinden-4-yl) (E)-2-phenylethenesulfonate Openeye Name: (1,7-dimethyl-3-oxo-indan-4-yl) (E)-2-phenylethenesulfonate CAS Name: (E)-2-phenylethenesulfonic acid (1,7-dimethyl-3-oxo-1,2-dihydroinden-4-yl) ester IUPAC Name: (1,7-dimethyl-3-oxo-1,2-dihydroinden-4-yl) (E)-2-phenylethenesulfonate Traditional Name: (E)-2-phenylethenesulfonic acid (3-keto-1,7-dimethyl-indan-4-yl) ester Formula: C19H18O4S MolecularWeight: 342.40882

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C2=C(C=CC(=C12)C)OS(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC1CC(=O)C2=C(C=CC(=C12)C)OS(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C19H18O4S/c1-13-8-9-17(19-16(20)12-14(2)18(13)19)23-24(21,22)11-10-15-6-4-3-5-7-15/h3-11,14H,12H2,1-2H3/b11-10+