5-(phenylmethyl)-1H-1,2-diazepin-1-ium chloride

Systemtic Name: 5-(phenylmethyl)-1H-1,2-diazepin-1-ium chloride Openeye Name: 5-benzyl-1H-diazepin-1-ium chloride CAS Name: 5-(phenylmethyl)-1H-diazepin-1-ium chloride IUPAC Name: 5-benzyl-1H-diazepin-1-ium chloride Traditional Name: 5-benzyl-1H-diazepin-1-ium chloride Formula: C12H13ClN2 MolecularWeight: 220.69802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=N[NH2+]C=C2.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=N[NH2+]C=C2.[Cl-]

InChI

InChI=1S/C12H12N2.ClH/c1-2-4-11(5-3-1)10-12-6-8-13-14-9-7-12;/h1-9,13H,10H2;1H