4-(1-butylpyridin-1-ium-4-yl)-3,5-dimethyl-phenol

Systemtic Name: 4-(1-butylpyridin-1-ium-4-yl)-3,5-dimethyl-phenol Openeye Name: 4-(1-butylpyridin-1-ium-4-yl)-3,5-dimethyl-phenol CAS Name: 4-(1-butyl-4-pyridin-1-iumyl)-3,5-dimethylphenol IUPAC Name: 4-(1-butylpyridin-1-ium-4-yl)-3,5-dimethylphenol Traditional Name: 4-(1-butylpyridin-1-ium-4-yl)-3,5-dimethyl-phenol Formula: C17H22NO+ MolecularWeight: 256.36268

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CC=C(C=C1)C2=C(C=C(C=C2C)O)C

Isomeric SMILES

CCCC[N+]1=CC=C(C=C1)C2=C(C=C(C=C2C)O)C

InChI

InChI=1S/C17H21NO/c1-4-5-8-18-9-6-15(7-10-18)17-13(2)11-16(19)12-14(17)3/h6-7,9-12H,4-5,8H2,1-3H3/p+1