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

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[2-[4-[bis(fluoranyl)methoxy]phenyl]ethyl]benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]benzamide Formula: C22H26F2N2O4S MolecularWeight: 452.514646

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC3=CC=C(C=C3)OC(F)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC3=CC=C(C=C3)OC(F)F

InChI

InChI=1S/C22H26F2N2O4S/c23-22(24)30-19-9-5-17(6-10-19)13-14-25-21(27)18-7-11-20(12-8-18)31(28,29)26-15-3-1-2-4-16-26/h5-12,22H,1-4,13-16H2,(H,25,27)