(2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-bis(furan-2-ylmethyl)azanium

Systemtic Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-bis(furan-2-ylmethyl)azanium Openeye Name: (2-ethoxycarbonylbenzofuran-3-yl)methyl-bis(2-furylmethyl)ammonium CAS Name: (2-ethoxycarbonyl-3-benzofuranyl)methyl-bis(2-furanylmethyl)ammonium IUPAC Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-bis(furan-2-ylmethyl)azanium Traditional Name: (2-carbethoxybenzofuran-3-yl)methyl-bis(2-furfuryl)ammonium Formula: C22H22NO5+ MolecularWeight: 380.41378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)C[NH+](CC3=CC=CO3)CC4=CC=CO4

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)C[NH+](CC3=CC=CO3)CC4=CC=CO4

InChI

InChI=1S/C22H21NO5/c1-2-25-22(24)21-19(18-9-3-4-10-20(18)28-21)15-23(13-16-7-5-11-26-16)14-17-8-6-12-27-17/h3-12H,2,13-15H2,1H3/p+1