(1,7-dimethyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 3,4-dihydronaphthalene-2-sulfonate

Systemtic Name: (1,7-dimethyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 3,4-dihydronaphthalene-2-sulfonate Openeye Name: (1,7-dimethyl-3-oxo-indan-4-yl) 3,4-dihydronaphthalene-2-sulfonate CAS Name: 3,4-dihydronaphthalene-2-sulfonic acid (1,7-dimethyl-3-oxo-1,2-dihydroinden-4-yl) ester IUPAC Name: (1,7-dimethyl-3-oxo-1,2-dihydroinden-4-yl) 3,4-dihydronaphthalene-2-sulfonate Traditional Name: 3,4-dihydronaphthalene-2-sulfonic acid (3-keto-1,7-dimethyl-indan-4-yl) ester Formula: C21H20O4S MolecularWeight: 368.4461

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C2=C(C=CC(=C12)C)OS(=O)(=O)C3=CC4=CC=CC=C4CC3

Isomeric SMILES

CC1CC(=O)C2=C(C=CC(=C12)C)OS(=O)(=O)C3=CC4=CC=CC=C4CC3

InChI

InChI=1S/C21H20O4S/c1-13-7-10-19(21-18(22)11-14(2)20(13)21)25-26(23,24)17-9-8-15-5-3-4-6-16(15)12-17/h3-7,10,12,14H,8-9,11H2,1-2H3