(7-fluoranyl-1-methyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 2-methoxy-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (7-fluoranyl-1-methyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 2-methoxy-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (7-fluoro-1-methyl-3-oxo-indan-4-yl) 2-methoxy-5-morpholinosulfonyl-benzoate CAS Name: 2-methoxy-5-(4-morpholinylsulfonyl)benzoic acid (7-fluoro-1-methyl-3-oxo-1,2-dihydroinden-4-yl) ester IUPAC Name: (7-fluoro-1-methyl-3-oxo-1,2-dihydroinden-4-yl) 2-methoxy-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-methoxy-5-morpholinosulfonyl-benzoic acid (7-fluoro-3-keto-1-methyl-indan-4-yl) ester Formula: C22H22FNO7S MolecularWeight: 463.475983

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C2=C(C=CC(=C12)F)OC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)OC

Isomeric SMILES

CC1CC(=O)C2=C(C=CC(=C12)F)OC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)OC

InChI

InChI=1S/C22H22FNO7S/c1-13-11-17(25)21-19(6-4-16(23)20(13)21)31-22(26)15-12-14(3-5-18(15)29-2)32(27,28)24-7-9-30-10-8-24/h3-6,12-13H,7-11H2,1-2H3