1-[4-[3,4-bis(chloranyl)phenoxy]butyl]azepan-1-ium

Systemtic Name: 1-[4-[3,4-bis(chloranyl)phenoxy]butyl]azepan-1-ium Openeye Name: 1-[4-(3,4-dichlorophenoxy)butyl]azepan-1-ium CAS Name: 1-[4-(3,4-dichlorophenoxy)butyl]azepan-1-ium IUPAC Name: 1-[4-(3,4-dichlorophenoxy)butyl]azepan-1-ium Traditional Name: 1-[4-(3,4-dichlorophenoxy)butyl]azepan-1-ium Formula: C16H24Cl2NO+ MolecularWeight: 317.27386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CCCCOC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C1CCC[NH+](CC1)CCCCOC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H23Cl2NO/c17-15-8-7-14(13-16(15)18)20-12-6-5-11-19-9-3-1-2-4-10-19/h7-8,13H,1-6,9-12H2/p+1