[2-oxidanylidene-2-(2,3,5,6-tetramethylphenyl)ethyl] 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-(2,3,5,6-tetramethylphenyl)ethyl] 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: [2-oxo-2-(2,3,5,6-tetramethylphenyl)ethyl] 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid [2-oxo-2-(2,3,5,6-tetramethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,3,5,6-tetramethylphenyl)ethyl] 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid [2-keto-2-(2,3,5,6-tetramethylphenyl)ethyl] ester Formula: C23H27NO5S MolecularWeight: 429.52918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C)C

InChI

InChI=1S/C23H27NO5S/c1-15-12-16(2)18(4)22(17(15)3)21(25)14-29-23(26)19-8-7-9-20(13-19)30(27,28)24-10-5-6-11-24/h7-9,12-13H,5-6,10-11,14H2,1-4H3