2-[4-[2,4-bis(fluoranyl)phenyl]carbonyl-1,4-diazepan-1-yl]-N-tert-butyl-ethanamide

Systemtic Name: 2-[4-[2,4-bis(fluoranyl)phenyl]carbonyl-1,4-diazepan-1-yl]-N-tert-butyl-ethanamide Openeye Name: N-tert-butyl-2-[4-(2,4-difluorobenzoyl)-1,4-diazepan-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[(2,4-difluorophenyl)-oxomethyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-tert-butyl-2-[4-(2,4-difluorobenzoyl)-1,4-diazepan-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-(2,4-difluorobenzoyl)-1,4-diazepan-1-yl]acetamide Formula: C18H25F2N3O2 MolecularWeight: 353.406806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1CCCN(CC1)C(=O)C2=C(C=C(C=C2)F)F

Isomeric SMILES

CC(C)(C)NC(=O)CN1CCCN(CC1)C(=O)C2=C(C=C(C=C2)F)F

InChI

InChI=1S/C18H25F2N3O2/c1-18(2,3)21-16(24)12-22-7-4-8-23(10-9-22)17(25)14-6-5-13(19)11-15(14)20/h5-6,11H,4,7-10,12H2,1-3H3,(H,21,24)