[(2R)-1-oxidanylidene-1-[(2,4,6-trimethylphenyl)amino]propan-2-yl] 2-methyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [(2R)-1-oxidanylidene-1-[(2,4,6-trimethylphenyl)amino]propan-2-yl] 2-methyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: [(1R)-1-methyl-2-oxo-2-(2,4,6-trimethylanilino)ethyl] 2-methyl-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-methyl-5-(1-piperidinylsulfonyl)benzoic acid [(2R)-1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl] 2-methyl-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-methyl-5-piperidinosulfonyl-benzoic acid [(1R)-2-keto-2-mesidino-1-methyl-ethyl] ester Formula: C25H32N2O5S MolecularWeight: 472.59698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OC(C)C(=O)NC3=C(C=C(C=C3C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)O[C@H](C)C(=O)NC3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C25H32N2O5S/c1-16-13-18(3)23(19(4)14-16)26-24(28)20(5)32-25(29)22-15-21(10-9-17(22)2)33(30,31)27-11-7-6-8-12-27/h9-10,13-15,20H,6-8,11-12H2,1-5H3,(H,26,28)/t20-/m1/s1