[4-[2-oxidanylidene-2-(pyridin-3-ylmethylamino)ethoxy]phenyl]methylazanium

Systemtic Name: [4-[2-oxidanylidene-2-(pyridin-3-ylmethylamino)ethoxy]phenyl]methylazanium Openeye Name: [4-[2-oxo-2-(3-pyridylmethylamino)ethoxy]phenyl]methylammonium CAS Name: [4-[2-oxo-2-(3-pyridinylmethylamino)ethoxy]phenyl]methylammonium IUPAC Name: [4-[2-oxo-2-(pyridin-3-ylmethylamino)ethoxy]phenyl]methylazanium Traditional Name: [4-[2-keto-2-(3-pyridylmethylamino)ethoxy]benzyl]ammonium Formula: C15H18N3O2+ MolecularWeight: 272.32232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC(=O)COC2=CC=C(C=C2)C[NH3+]

Isomeric SMILES

C1=CC(=CN=C1)CNC(=O)COC2=CC=C(C=C2)C[NH3+]

InChI

InChI=1S/C15H17N3O2/c16-8-12-3-5-14(6-4-12)20-11-15(19)18-10-13-2-1-7-17-9-13/h1-7,9H,8,10-11,16H2,(H,18,19)/p+1