5-[(4-propan-2-ylphenoxy)methyl]-N-pyridin-1-ium-3-yl-furan-2-carboxamide

Systemtic Name: 5-[(4-propan-2-ylphenoxy)methyl]-N-pyridin-1-ium-3-yl-furan-2-carboxamide Openeye Name: 5-[(4-isopropylphenoxy)methyl]-N-pyridin-1-ium-3-yl-furan-2-carboxamide CAS Name: 5-[(4-propan-2-ylphenoxy)methyl]-N-(3-pyridin-1-iumyl)-2-furancarboxamide IUPAC Name: 5-[(4-propan-2-ylphenoxy)methyl]-N-pyridin-1-ium-3-ylfuran-2-carboxamide Traditional Name: 5-[(4-isopropylphenoxy)methyl]-N-pyridin-1-ium-3-yl-2-furamide Formula: C20H21N2O3+ MolecularWeight: 337.39234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=C[NH+]=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=C[NH+]=CC=C3

InChI

InChI=1S/C20H20N2O3/c1-14(2)15-5-7-17(8-6-15)24-13-18-9-10-19(25-18)20(23)22-16-4-3-11-21-12-16/h3-12,14H,13H2,1-2H3,(H,22,23)/p+1