2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-(3-oxidanylpyridin-1-ium-2-yl)ethanamide

Systemtic Name: 2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)-N-(3-oxidanylpyridin-1-ium-2-yl)ethanamide Openeye Name: N-(3-hydroxypyridin-1-ium-2-yl)-2-(5-isopropyl-6-methyl-benzofuran-3-yl)acetamide CAS Name: N-(3-hydroxy-2-pyridin-1-iumyl)-2-(6-methyl-5-propan-2-yl-3-benzofuranyl)acetamide IUPAC Name: N-(3-hydroxypyridin-1-ium-2-yl)-2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)acetamide Traditional Name: N-(3-hydroxypyridin-1-ium-2-yl)-2-(5-isopropyl-6-methyl-benzofuran-3-yl)acetamide Formula: C19H21N2O3+ MolecularWeight: 325.38164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC=C2CC(=O)NC3=C(C=CC=[NH+]3)O)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)OC=C2CC(=O)NC3=C(C=CC=[NH+]3)O)C(C)C

InChI

InChI=1S/C19H20N2O3/c1-11(2)14-9-15-13(10-24-17(15)7-12(14)3)8-18(23)21-19-16(22)5-4-6-20-19/h4-7,9-11,22H,8H2,1-3H3,(H,20,21,23)/p+1