[2-oxidanylidene-2-(2,3,5,6-tetramethylphenyl)ethyl] 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: [2-oxidanylidene-2-(2,3,5,6-tetramethylphenyl)ethyl] 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: [2-oxo-2-(2,3,5,6-tetramethylphenyl)ethyl] 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-methoxy-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] 4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-methoxy-3-pyrrolidinosulfonyl-benzoic acid [2-keto-2-(2,3,5,6-tetramethylphenyl)ethyl] ester Formula: C24H29NO6S MolecularWeight: 459.55516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29NO6S/c1-15-12-16(2)18(4)23(17(15)3)20(26)14-31-24(27)19-8-9-21(30-5)22(13-19)32(28,29)25-10-6-7-11-25/h8-9,12-13H,6-7,10-11,14H2,1-5H3