[2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] (2R)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: [2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] (2R)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxylate Openeye Name: [2-(2,6-diethylanilino)-2-oxo-ethyl] (2R)-1-(p-tolylsulfonyl)piperidine-2-carboxylate CAS Name: (2R)-1-(4-methylphenyl)sulfonyl-2-piperidinecarboxylic acid [2-(2,6-diethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-diethylanilino)-2-oxoethyl] (2R)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxylate Traditional Name: (2R)-1-tosylpipecolinic acid [2-(2,6-diethylanilino)-2-keto-ethyl] ester Formula: C25H32N2O5S MolecularWeight: 472.59698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)COC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)COC(=O)[C@H]2CCCCN2S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H32N2O5S/c1-4-19-9-8-10-20(5-2)24(19)26-23(28)17-32-25(29)22-11-6-7-16-27(22)33(30,31)21-14-12-18(3)13-15-21/h8-10,12-15,22H,4-7,11,16-17H2,1-3H3,(H,26,28)/t22-/m1/s1