1-phenyl-3-(pyridin-1-ium-2-ylamino)propan-1-ol chloride

Systemtic Name: 1-phenyl-3-(pyridin-1-ium-2-ylamino)propan-1-ol chloride Openeye Name: 1-phenyl-3-(pyridin-1-ium-2-ylamino)propan-1-ol chloride CAS Name: 1-phenyl-3-(2-pyridin-1-iumylamino)-1-propanol chloride IUPAC Name: 1-phenyl-3-(pyridin-1-ium-2-ylamino)propan-1-ol chloride Traditional Name: 1-phenyl-3-(pyridin-1-ium-2-ylamino)propan-1-ol chloride Formula: C14H17ClN2O MolecularWeight: 264.75058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCNC2=CC=CC=[NH+]2)O.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C(CCNC2=CC=CC=[NH+]2)O.[Cl-]

InChI

InChI=1S/C14H16N2O.ClH/c17-13(12-6-2-1-3-7-12)9-11-16-14-8-4-5-10-15-14;/h1-8,10,13,17H,9,11H2,(H,15,16);1H