[2-chloranyl-6-(3-pyridin-4-ylpropoxy)phenyl]methylazanium

Systemtic Name: [2-chloranyl-6-(3-pyridin-4-ylpropoxy)phenyl]methylazanium Openeye Name: [2-chloro-6-[3-(4-pyridyl)propoxy]phenyl]methylammonium CAS Name: [2-chloro-6-(3-pyridin-4-ylpropoxy)phenyl]methylammonium IUPAC Name: [2-chloro-6-(3-pyridin-4-ylpropoxy)phenyl]methylazanium Traditional Name: [2-chloro-6-[3-(4-pyridyl)propoxy]benzyl]ammonium Formula: C15H18ClN2O+ MolecularWeight: 277.76922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)C[NH3+])OCCCC2=CC=NC=C2

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)C[NH3+])OCCCC2=CC=NC=C2

InChI

InChI=1S/C15H17ClN2O/c16-14-4-1-5-15(13(14)11-17)19-10-2-3-12-6-8-18-9-7-12/h1,4-9H,2-3,10-11,17H2/p+1