1-(4-chlorophenyl)-1,4-diazepan-4-ium

Systemtic Name: 1-(4-chlorophenyl)-1,4-diazepan-4-ium Openeye Name: 1-(4-chlorophenyl)-1,4-diazepan-4-ium CAS Name: 1-(4-chlorophenyl)-1,4-diazepan-4-ium IUPAC Name: 1-(4-chlorophenyl)-1,4-diazepan-4-ium Traditional Name: 1-(4-chlorophenyl)-1,4-diazepan-4-ium Formula: C11H16ClN2+ MolecularWeight: 211.71114

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(C1)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1C[NH2+]CCN(C1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C11H15ClN2/c12-10-2-4-11(5-3-10)14-8-1-6-13-7-9-14/h2-5,13H,1,6-9H2/p+1