[2-oxidanylidene-2-(2,3,5,6-tetramethylphenyl)ethyl] 4-piperidin-1-ylsulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-(2,3,5,6-tetramethylphenyl)ethyl] 4-piperidin-1-ylsulfonylbenzoate Openeye Name: [2-oxo-2-(2,3,5,6-tetramethylphenyl)ethyl] 4-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinylsulfonyl)benzoic acid [2-oxo-2-(2,3,5,6-tetramethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,3,5,6-tetramethylphenyl)ethyl] 4-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidinosulfonylbenzoic acid [2-keto-2-(2,3,5,6-tetramethylphenyl)ethyl] ester Formula: C24H29NO5S MolecularWeight: 443.55576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)C(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)C(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C)C

InChI

InChI=1S/C24H29NO5S/c1-16-14-17(2)19(4)23(18(16)3)22(26)15-30-24(27)20-8-10-21(11-9-20)31(28,29)25-12-6-5-7-13-25/h8-11,14H,5-7,12-13,15H2,1-4H3