3-(1-phenethylpyridin-1-ium-4-yl)propan-1-ol

Systemtic Name: 3-(1-phenethylpyridin-1-ium-4-yl)propan-1-ol Openeye Name: 3-(1-phenethylpyridin-1-ium-4-yl)propan-1-ol CAS Name: 3-(1-phenethyl-4-pyridin-1-iumyl)-1-propanol IUPAC Name: 3-(1-phenethylpyridin-1-ium-4-yl)propan-1-ol Traditional Name: 3-(1-phenethylpyridin-1-ium-4-yl)propan-1-ol Formula: C16H20NO+ MolecularWeight: 242.3361

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC[N+]2=CC=C(C=C2)CCCO

Isomeric SMILES

C1=CC=C(C=C1)CC[N+]2=CC=C(C=C2)CCCO

InChI

InChI=1S/C16H20NO/c18-14-4-7-16-9-12-17(13-10-16)11-8-15-5-2-1-3-6-15/h1-3,5-6,9-10,12-13,18H,4,7-8,11,14H2/q+1