N-[(2,6-dimethylpiperidin-1-ium-1-ylidene)-phenyl-methyl]propan-1-amine bromide

Systemtic Name: N-[(2,6-dimethylpiperidin-1-ium-1-ylidene)-phenyl-methyl]propan-1-amine bromide Openeye Name: N-[(2,6-dimethylpiperidin-1-ium-1-ylidene)-phenyl-methyl]propan-1-amine bromide CAS Name: N-[(2,6-dimethyl-1-piperidin-1-iumylidene)-phenylmethyl]-1-propanamine bromide IUPAC Name: N-[(2,6-dimethylpiperidin-1-ium-1-ylidene)-phenylmethyl]propan-1-amine bromide Traditional Name: [(2,6-dimethylpiperidin-1-ium-1-ylidene)-phenyl-methyl]-propyl-amine bromide Formula: C17H27BrN2 MolecularWeight: 339.31368

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=[N+]1C(CCCC1C)C)C2=CC=CC=C2.[Br-]

Isomeric SMILES

CCCNC(=[N+]1C(CCCC1C)C)C2=CC=CC=C2.[Br-]

InChI

InChI=1S/C17H26N2.BrH/c1-4-13-18-17(16-11-6-5-7-12-16)19-14(2)9-8-10-15(19)3;/h5-7,11-12,14-15H,4,8-10,13H2,1-3H3;1H