4-methylsulfonyl-N-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]benzamide

Systemtic Name: 4-methylsulfonyl-N-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]benzamide Openeye Name: 4-methylsulfonyl-N-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]benzamide CAS Name: 4-methylsulfonyl-N-[3-[3-(1-pyrrolidinylmethyl)phenoxy]propyl]benzamide IUPAC Name: 4-methylsulfonyl-N-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]benzamide Traditional Name: 4-mesyl-N-[3-[3-(pyrrolidinomethyl)phenoxy]propyl]benzamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NCCCOC2=CC=CC(=C2)CN3CCCC3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NCCCOC2=CC=CC(=C2)CN3CCCC3

InChI

InChI=1S/C22H28N2O4S/c1-29(26,27)21-10-8-19(9-11-21)22(25)23-12-5-15-28-20-7-4-6-18(16-20)17-24-13-2-3-14-24/h4,6-11,16H,2-3,5,12-15,17H2,1H3,(H,23,25)