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dimethyl-[(2-methyl-5-oxidanyl-3-phenethyloxycarbonyl-1-benzofuran-4-yl)methyl]azanium

dimethyl-[(2-methyl-5-oxidanyl-3-phenethyloxycarbonyl-1-benzofuran-4-yl)methyl]azanium

Systemtic Name:dimethyl-[(2-methyl-5-oxidanyl-3-phenethyloxycarbonyl-1-benzofuran-4-yl)methyl]azanium
Openeye Name:(5-hydroxy-2-methyl-3-phenethyloxycarbonyl-benzofuran-4-yl)methyl-dimethyl-ammonium
CAS Name:[5-hydroxy-2-methyl-3-[oxo(phenethyloxy)methyl]-4-benzofuranyl]methyl-dimethylammonium
IUPAC Name:(5-hydroxy-2-methyl-3-phenethyloxycarbonyl-1-benzofuran-4-yl)methyl-dimethylazanium
Traditional Name:(5-hydroxy-2-methyl-3-phenethyloxycarbonyl-benzofuran-4-yl)methyl-dimethyl-ammonium
Formula: C21H24NO4+
MolecularWeight: 354.41956
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2C[NH+](C)C)O)C(=O)OCCC3=CC=CC=C3


Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2C[NH+](C)C)O)C(=O)OCCC3=CC=CC=C3


InChI

InChI=1S/C21H23NO4/c1-14-19(21(24)25-12-11-15-7-5-4-6-8-15)20-16(13-22(2)3)17(23)9-10-18(20)26-14/h4-10,23H,11-13H2,1-3H3/p+1


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