N-[[4-(dimethylaminomethyl)phenyl]methyl]-4-fluoranyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[[4-(dimethylaminomethyl)phenyl]methyl]-4-fluoranyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[[4-(dimethylaminomethyl)phenyl]methyl]-4-fluoro-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[[4-(dimethylaminomethyl)phenyl]methyl]-4-fluoro-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[[4-(dimethylaminomethyl)phenyl]methyl]-4-fluoro-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[4-(dimethylaminomethyl)benzyl]-4-fluoro-3-piperidinosulfonyl-benzamide Formula: C22H28FN3O3S MolecularWeight: 433.539423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CN(C)CC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H28FN3O3S/c1-25(2)16-18-8-6-17(7-9-18)15-24-22(27)19-10-11-20(23)21(14-19)30(28,29)26-12-4-3-5-13-26/h6-11,14H,3-5,12-13,15-16H2,1-2H3,(H,24,27)