(2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-methyl-phenethyl-azanium

Systemtic Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-methyl-phenethyl-azanium Openeye Name: (2-ethoxycarbonylbenzofuran-3-yl)methyl-methyl-phenethyl-ammonium CAS Name: (2-ethoxycarbonyl-3-benzofuranyl)methyl-methyl-phenethylammonium IUPAC Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-methyl-phenethylazanium Traditional Name: (2-carbethoxybenzofuran-3-yl)methyl-methyl-phenethyl-ammonium Formula: C21H24NO3+ MolecularWeight: 338.42016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)C[NH+](C)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)C[NH+](C)CCC3=CC=CC=C3

InChI

InChI=1S/C21H23NO3/c1-3-24-21(23)20-18(17-11-7-8-12-19(17)25-20)15-22(2)14-13-16-9-5-4-6-10-16/h4-12H,3,13-15H2,1-2H3/p+1