(2,4-dimethoxyphenyl)methyl-[(2-ethoxycarbonyl-1-benzofuran-3-yl)methyl]-methyl-azanium

Systemtic Name: (2,4-dimethoxyphenyl)methyl-[(2-ethoxycarbonyl-1-benzofuran-3-yl)methyl]-methyl-azanium Openeye Name: (2,4-dimethoxyphenyl)methyl-[(2-ethoxycarbonylbenzofuran-3-yl)methyl]-methyl-ammonium CAS Name: (2,4-dimethoxyphenyl)methyl-[(2-ethoxycarbonyl-3-benzofuranyl)methyl]-methylammonium IUPAC Name: (2,4-dimethoxyphenyl)methyl-[(2-ethoxycarbonyl-1-benzofuran-3-yl)methyl]-methylazanium Traditional Name: (2-carbethoxybenzofuran-3-yl)methyl-(2,4-dimethoxybenzyl)-methyl-ammonium Formula: C22H26NO5+ MolecularWeight: 384.44554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)C[NH+](C)CC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)C[NH+](C)CC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C22H25NO5/c1-5-27-22(24)21-18(17-8-6-7-9-19(17)28-21)14-23(2)13-15-10-11-16(25-3)12-20(15)26-4/h6-12H,5,13-14H2,1-4H3/p+1