N-[(2S)-3-(2,6-dimethylphenoxy)-2-oxidanyl-propyl]-2-piperidin-1-ylcarbonyl-benzenesulfonamide

Systemtic Name: N-[(2S)-3-(2,6-dimethylphenoxy)-2-oxidanyl-propyl]-2-piperidin-1-ylcarbonyl-benzenesulfonamide Openeye Name: N-[(2S)-3-(2,6-dimethylphenoxy)-2-hydroxy-propyl]-2-(piperidine-1-carbonyl)benzenesulfonamide CAS Name: N-[(2S)-3-(2,6-dimethylphenoxy)-2-hydroxypropyl]-2-[oxo(1-piperidinyl)methyl]benzenesulfonamide IUPAC Name: N-[(2S)-3-(2,6-dimethylphenoxy)-2-hydroxypropyl]-2-(piperidine-1-carbonyl)benzenesulfonamide Traditional Name: N-[(2S)-3-(2,6-dimethylphenoxy)-2-hydroxy-propyl]-2-(piperidine-1-carbonyl)benzenesulfonamide Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(CNS(=O)(=O)C2=CC=CC=C2C(=O)N3CCCCC3)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC[C@H](CNS(=O)(=O)C2=CC=CC=C2C(=O)N3CCCCC3)O

InChI

InChI=1S/C23H30N2O5S/c1-17-9-8-10-18(2)22(17)30-16-19(26)15-24-31(28,29)21-12-5-4-11-20(21)23(27)25-13-6-3-7-14-25/h4-5,8-12,19,24,26H,3,6-7,13-16H2,1-2H3/t19-/m0/s1