1-[[2,6-bis(chloranyl)phenyl]methyl]-1,4-diazepan-1-ium

Systemtic Name: 1-[[2,6-bis(chloranyl)phenyl]methyl]-1,4-diazepan-1-ium Openeye Name: 1-[(2,6-dichlorophenyl)methyl]-1,4-diazepan-1-ium CAS Name: 1-[(2,6-dichlorophenyl)methyl]-1,4-diazepan-1-ium IUPAC Name: 1-[(2,6-dichlorophenyl)methyl]-1,4-diazepan-1-ium Traditional Name: 1-(2,6-dichlorobenzyl)-1,4-diazepan-1-ium Formula: C12H17Cl2N2+ MolecularWeight: 260.18278

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC[NH+](C1)CC2=C(C=CC=C2Cl)Cl

Isomeric SMILES

C1CNCC[NH+](C1)CC2=C(C=CC=C2Cl)Cl

InChI

InChI=1S/C12H16Cl2N2/c13-11-3-1-4-12(14)10(11)9-16-7-2-5-15-6-8-16/h1,3-4,15H,2,5-9H2/p+1