butyl-[(2-ethoxycarbonyl-4-oxidanyl-1-benzofuran-3-yl)methyl]azanium chloride

Systemtic Name: butyl-[(2-ethoxycarbonyl-4-oxidanyl-1-benzofuran-3-yl)methyl]azanium chloride Openeye Name: butyl-[(2-ethoxycarbonyl-4-hydroxy-benzofuran-3-yl)methyl]ammonium chloride CAS Name: butyl-[(2-ethoxycarbonyl-4-hydroxy-3-benzofuranyl)methyl]ammonium chloride IUPAC Name: butyl-[(2-ethoxycarbonyl-4-hydroxy-1-benzofuran-3-yl)methyl]azanium chloride Traditional Name: butyl-[(2-carbethoxy-4-hydroxy-benzofuran-3-yl)methyl]ammonium chloride Formula: C16H22ClNO4 MolecularWeight: 327.80318

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]CC1=C(OC2=C1C(=CC=C2)O)C(=O)OCC.[Cl-]

Isomeric SMILES

CCCC[NH2+]CC1=C(OC2=C1C(=CC=C2)O)C(=O)OCC.[Cl-]

InChI

InChI=1S/C16H21NO4.ClH/c1-3-5-9-17-10-11-14-12(18)7-6-8-13(14)21-15(11)16(19)20-4-2;/h6-8,17-18H,3-5,9-10H2,1-2H3;1H