5-[(2,5-dimethylphenoxy)methyl]-N-pyridin-1-ium-4-yl-furan-2-carboxamide

Systemtic Name: 5-[(2,5-dimethylphenoxy)methyl]-N-pyridin-1-ium-4-yl-furan-2-carboxamide Openeye Name: 5-[(2,5-dimethylphenoxy)methyl]-N-pyridin-1-ium-4-yl-furan-2-carboxamide CAS Name: 5-[(2,5-dimethylphenoxy)methyl]-N-(4-pyridin-1-iumyl)-2-furancarboxamide IUPAC Name: 5-[(2,5-dimethylphenoxy)methyl]-N-pyridin-1-ium-4-ylfuran-2-carboxamide Traditional Name: 5-[(2,5-dimethylphenoxy)methyl]-N-pyridin-1-ium-4-yl-2-furamide Formula: C19H19N2O3+ MolecularWeight: 323.36576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC2=CC=C(O2)C(=O)NC3=CC=[NH+]C=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC2=CC=C(O2)C(=O)NC3=CC=[NH+]C=C3

InChI

InChI=1S/C19H18N2O3/c1-13-3-4-14(2)18(11-13)23-12-16-5-6-17(24-16)19(22)21-15-7-9-20-10-8-15/h3-11H,12H2,1-2H3,(H,20,21,22)/p+1