[3-[(2-ethanoyl-1-benzofuran-7-yl)oxy]-2-oxidanyl-propyl]-propan-2-yl-azanium chloride

Systemtic Name: [3-[(2-ethanoyl-1-benzofuran-7-yl)oxy]-2-oxidanyl-propyl]-propan-2-yl-azanium chloride Openeye Name: [3-(2-acetylbenzofuran-7-yl)oxy-2-hydroxy-propyl]-isopropyl-ammonium chloride CAS Name: [3-[(2-acetyl-7-benzofuranyl)oxy]-2-hydroxypropyl]-propan-2-ylammonium chloride IUPAC Name: [3-[(2-acetyl-1-benzofuran-7-yl)oxy]-2-hydroxypropyl]-propan-2-ylazanium chloride Traditional Name: [3-(2-acetylbenzofuran-7-yl)oxy-2-hydroxy-propyl]-isopropyl-ammonium chloride Formula: C16H22ClNO4 MolecularWeight: 327.80318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH2+]CC(COC1=CC=CC2=C1OC(=C2)C(=O)C)O.[Cl-]

Isomeric SMILES

CC(C)[NH2+]CC(COC1=CC=CC2=C1OC(=C2)C(=O)C)O.[Cl-]

InChI

InChI=1S/C16H21NO4.ClH/c1-10(2)17-8-13(19)9-20-14-6-4-5-12-7-15(11(3)18)21-16(12)14;/h4-7,10,13,17,19H,8-9H2,1-3H3;1H