[5-bromanyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]methylazanium

Systemtic Name: [5-bromanyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]methylazanium Openeye Name: [5-bromo-2-[2-oxo-2-(1-piperidyl)ethoxy]phenyl]methylammonium CAS Name: [5-bromo-2-[2-oxo-2-(1-piperidinyl)ethoxy]phenyl]methylammonium IUPAC Name: [5-bromo-2-(2-oxo-2-piperidin-1-ylethoxy)phenyl]methylazanium Traditional Name: [5-bromo-2-(2-keto-2-piperidino-ethoxy)benzyl]ammonium Formula: C14H20BrN2O2+ MolecularWeight: 328.2248

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)COC2=C(C=C(C=C2)Br)C[NH3+]

Isomeric SMILES

C1CCN(CC1)C(=O)COC2=C(C=C(C=C2)Br)C[NH3+]

InChI

InChI=1S/C14H19BrN2O2/c15-12-4-5-13(11(8-12)9-16)19-10-14(18)17-6-2-1-3-7-17/h4-5,8H,1-3,6-7,9-10,16H2/p+1