2-(4-bromanylphenoxy)-1-(4-methyl-1,4-diazepan-1-yl)butan-1-one

Systemtic Name: 2-(4-bromanylphenoxy)-1-(4-methyl-1,4-diazepan-1-yl)butan-1-one Openeye Name: 2-(4-bromophenoxy)-1-(4-methyl-1,4-diazepan-1-yl)butan-1-one CAS Name: 2-(4-bromophenoxy)-1-(4-methyl-1,4-diazepan-1-yl)-1-butanone IUPAC Name: 2-(4-bromophenoxy)-1-(4-methyl-1,4-diazepan-1-yl)butan-1-one Traditional Name: 2-(4-bromophenoxy)-1-(4-methyl-1,4-diazepan-1-yl)butan-1-one Formula: C16H23BrN2O2 MolecularWeight: 355.27002

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCCN(CC1)C)OC2=CC=C(C=C2)Br

Isomeric SMILES

CCC(C(=O)N1CCCN(CC1)C)OC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H23BrN2O2/c1-3-15(21-14-7-5-13(17)6-8-14)16(20)19-10-4-9-18(2)11-12-19/h5-8,15H,3-4,9-12H2,1-2H3