2-(4-chloranylphenoxy)-1-[4-(4-fluorophenyl)carbonyl-1,4-diazepan-1-yl]-2-methyl-propan-1-one

Systemtic Name: 2-(4-chloranylphenoxy)-1-[4-(4-fluorophenyl)carbonyl-1,4-diazepan-1-yl]-2-methyl-propan-1-one Openeye Name: 2-(4-chlorophenoxy)-1-[4-(4-fluorobenzoyl)-1,4-diazepan-1-yl]-2-methyl-propan-1-one CAS Name: 2-(4-chlorophenoxy)-1-[4-[(4-fluorophenyl)-oxomethyl]-1,4-diazepan-1-yl]-2-methyl-1-propanone IUPAC Name: 2-(4-chlorophenoxy)-1-[4-(4-fluorobenzoyl)-1,4-diazepan-1-yl]-2-methylpropan-1-one Traditional Name: 2-(4-chlorophenoxy)-1-[4-(4-fluorobenzoyl)-1,4-diazepan-1-yl]-2-methyl-propan-1-one Formula: C22H24ClFN2O3 MolecularWeight: 418.888963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N1CCCN(CC1)C(=O)C2=CC=C(C=C2)F)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C(=O)N1CCCN(CC1)C(=O)C2=CC=C(C=C2)F)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H24ClFN2O3/c1-22(2,29-19-10-6-17(23)7-11-19)21(28)26-13-3-12-25(14-15-26)20(27)16-4-8-18(24)9-5-16/h4-11H,3,12-15H2,1-2H3