3-(azepan-1-ylsulfonyl)-N-[2-[bis(fluoranyl)methoxy]phenyl]-4-methyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[2-[bis(fluoranyl)methoxy]phenyl]-4-methyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[2-(difluoromethoxy)phenyl]-4-methyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[2-(difluoromethoxy)phenyl]-4-methylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[2-(difluoromethoxy)phenyl]-4-methylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[2-(difluoromethoxy)phenyl]-4-methyl-benzamide Formula: C21H24F2N2O4S MolecularWeight: 438.488066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2OC(F)F)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2OC(F)F)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C21H24F2N2O4S/c1-15-10-11-16(14-19(15)30(27,28)25-12-6-2-3-7-13-25)20(26)24-17-8-4-5-9-18(17)29-21(22)23/h4-5,8-11,14,21H,2-3,6-7,12-13H2,1H3,(H,24,26)