[(2S)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl] 3-[(3,4-dimethylphenyl)sulfonylamino]propanoate

Systemtic Name: [(2S)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl] 3-[(3,4-dimethylphenyl)sulfonylamino]propanoate Openeye Name: [(1S)-1-methyl-2-(4-methyl-1-piperidyl)-2-oxo-ethyl] 3-[(3,4-dimethylphenyl)sulfonylamino]propanoate CAS Name: 3-[(3,4-dimethylphenyl)sulfonylamino]propanoic acid [(2S)-1-(4-methyl-1-piperidinyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-methylpiperidin-1-yl)-1-oxopropan-2-yl] 3-[(3,4-dimethylphenyl)sulfonylamino]propanoate Traditional Name: 3-[(3,4-dimethylphenyl)sulfonylamino]propionic acid [(1S)-2-keto-1-methyl-2-(4-methylpiperidino)ethyl] ester Formula: C20H30N2O5S MolecularWeight: 410.5276

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(C)OC(=O)CCNS(=O)(=O)C2=CC(=C(C=C2)C)C

Isomeric SMILES

CC1CCN(CC1)C(=O)[C@H](C)OC(=O)CCNS(=O)(=O)C2=CC(=C(C=C2)C)C

InChI

InChI=1S/C20H30N2O5S/c1-14-8-11-22(12-9-14)20(24)17(4)27-19(23)7-10-21-28(25,26)18-6-5-15(2)16(3)13-18/h5-6,13-14,17,21H,7-12H2,1-4H3/t17-/m0/s1