(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 4-methyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 4-methyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: (1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl) 4-methyl-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-methyl-3-(1-piperidinylsulfonyl)benzoic acid [1-oxo-1-(1-pyrrolidinyl)propan-2-yl] ester IUPAC Name: (1-oxo-1-pyrrolidin-1-ylpropan-2-yl) 4-methyl-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-methyl-3-piperidinosulfonyl-benzoic acid (2-keto-1-methyl-2-pyrrolidino-ethyl) ester Formula: C20H28N2O5S MolecularWeight: 408.51172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC(C)C(=O)N2CCCC2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC(C)C(=O)N2CCCC2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H28N2O5S/c1-15-8-9-17(14-18(15)28(25,26)22-12-4-3-5-13-22)20(24)27-16(2)19(23)21-10-6-7-11-21/h8-9,14,16H,3-7,10-13H2,1-2H3