1-(azepan-1-yl)-4-[2,4-bis(chloranyl)phenoxy]butan-1-one

Systemtic Name: 1-(azepan-1-yl)-4-[2,4-bis(chloranyl)phenoxy]butan-1-one Openeye Name: 1-(azepan-1-yl)-4-(2,4-dichlorophenoxy)butan-1-one CAS Name: 1-(1-azepanyl)-4-(2,4-dichlorophenoxy)-1-butanone IUPAC Name: 1-(azepan-1-yl)-4-(2,4-dichlorophenoxy)butan-1-one Traditional Name: 1-(azepan-1-yl)-4-(2,4-dichlorophenoxy)butan-1-one Formula: C16H21Cl2NO2 MolecularWeight: 330.24944

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H21Cl2NO2/c17-13-7-8-15(14(18)12-13)21-11-5-6-16(20)19-9-3-1-2-4-10-19/h7-8,12H,1-6,9-11H2