[(1S)-7-fluoranyl-1-methyl-3-oxidanylidene-1,2-dihydroinden-4-yl] 4-chloranyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [(1S)-7-fluoranyl-1-methyl-3-oxidanylidene-1,2-dihydroinden-4-yl] 4-chloranyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: [(1S)-7-fluoro-1-methyl-3-oxo-indan-4-yl] 4-chloro-3-morpholinosulfonyl-benzoate CAS Name: 4-chloro-3-(4-morpholinylsulfonyl)benzoic acid [(1S)-7-fluoro-1-methyl-3-oxo-1,2-dihydroinden-4-yl] ester IUPAC Name: [(1S)-7-fluoro-1-methyl-3-oxo-1,2-dihydroinden-4-yl] 4-chloro-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-chloro-3-morpholinosulfonyl-benzoic acid [(1S)-7-fluoro-3-keto-1-methyl-indan-4-yl] ester Formula: C21H19ClFNO6S MolecularWeight: 467.895063

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H]1CC(=O)C2=C(C=CC(=C12)F)OC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H19ClFNO6S/c1-12-10-16(25)20-17(5-4-15(23)19(12)20)30-21(26)13-2-3-14(22)18(11-13)31(27,28)24-6-8-29-9-7-24/h2-5,11-12H,6-10H2,1H3/t12-/m0/s1