3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-(4-fluoranylphenoxy)ethyl]-N-methyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-(4-fluoranylphenoxy)ethyl]-N-methyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(4-fluorophenoxy)ethyl]-N-methyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[2-(4-fluorophenoxy)ethyl]-N-methylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(4-fluorophenoxy)ethyl]-N-methylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(4-fluorophenoxy)ethyl]-N-methyl-benzamide Formula: C22H26ClFN2O4S MolecularWeight: 468.969243

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)F)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)F)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H26ClFN2O4S/c1-25(14-15-30-19-9-7-18(24)8-10-19)22(27)17-6-11-20(23)21(16-17)31(28,29)26-12-4-2-3-5-13-26/h6-11,16H,2-5,12-15H2,1H3