(1,7-dimethyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 5-chloranylthiophene-2-sulfonate

Systemtic Name: (1,7-dimethyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 5-chloranylthiophene-2-sulfonate Openeye Name: (1,7-dimethyl-3-oxo-indan-4-yl) 5-chlorothiophene-2-sulfonate CAS Name: 5-chloro-2-thiophenesulfonic acid (1,7-dimethyl-3-oxo-1,2-dihydroinden-4-yl) ester IUPAC Name: (1,7-dimethyl-3-oxo-1,2-dihydroinden-4-yl) 5-chlorothiophene-2-sulfonate Traditional Name: 5-chlorothiophene-2-sulfonic acid (3-keto-1,7-dimethyl-indan-4-yl) ester Formula: C15H13ClO4S2 MolecularWeight: 356.84432

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C2=C(C=CC(=C12)C)OS(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CC1CC(=O)C2=C(C=CC(=C12)C)OS(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C15H13ClO4S2/c1-8-3-4-11(15-10(17)7-9(2)14(8)15)20-22(18,19)13-6-5-12(16)21-13/h3-6,9H,7H2,1-2H3