(2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-[(2-methoxyphenyl)methyl]-methyl-azanium

Systemtic Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-[(2-methoxyphenyl)methyl]-methyl-azanium Openeye Name: (2-ethoxycarbonylbenzofuran-3-yl)methyl-[(2-methoxyphenyl)methyl]-methyl-ammonium CAS Name: (2-ethoxycarbonyl-3-benzofuranyl)methyl-[(2-methoxyphenyl)methyl]-methylammonium IUPAC Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-[(2-methoxyphenyl)methyl]-methylazanium Traditional Name: (2-carbethoxybenzofuran-3-yl)methyl-methyl-o-anisyl-ammonium Formula: C21H24NO4+ MolecularWeight: 354.41956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)C[NH+](C)CC3=CC=CC=C3OC

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)C[NH+](C)CC3=CC=CC=C3OC

InChI

InChI=1S/C21H23NO4/c1-4-25-21(23)20-17(16-10-6-8-12-19(16)26-20)14-22(2)13-15-9-5-7-11-18(15)24-3/h5-12H,4,13-14H2,1-3H3/p+1