(2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-[(4-ethoxy-3-methoxy-phenyl)methyl]-methyl-azanium

Systemtic Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-[(4-ethoxy-3-methoxy-phenyl)methyl]-methyl-azanium Openeye Name: (2-ethoxycarbonylbenzofuran-3-yl)methyl-[(4-ethoxy-3-methoxy-phenyl)methyl]-methyl-ammonium CAS Name: (2-ethoxycarbonyl-3-benzofuranyl)methyl-[(4-ethoxy-3-methoxyphenyl)methyl]-methylammonium IUPAC Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-[(4-ethoxy-3-methoxyphenyl)methyl]-methylazanium Traditional Name: (2-carbethoxybenzofuran-3-yl)methyl-(4-ethoxy-3-methoxy-benzyl)-methyl-ammonium Formula: C23H28NO5+ MolecularWeight: 398.47212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH+](C)CC2=C(OC3=CC=CC=C32)C(=O)OCC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH+](C)CC2=C(OC3=CC=CC=C32)C(=O)OCC)OC

InChI

InChI=1S/C23H27NO5/c1-5-27-20-12-11-16(13-21(20)26-4)14-24(3)15-18-17-9-7-8-10-19(17)29-22(18)23(25)28-6-2/h7-13H,5-6,14-15H2,1-4H3/p+1