[5-[3,5-bis(methoxycarbonyl)phenyl]furan-2-yl]methyl-phenethyl-azanium

Systemtic Name: [5-[3,5-bis(methoxycarbonyl)phenyl]furan-2-yl]methyl-phenethyl-azanium Openeye Name: [5-[3,5-bis(methoxycarbonyl)phenyl]-2-furyl]methyl-phenethyl-ammonium CAS Name: [5-[3,5-bis(methoxycarbonyl)phenyl]-2-furanyl]methyl-phenethylammonium IUPAC Name: [5-[3,5-bis(methoxycarbonyl)phenyl]furan-2-yl]methyl-phenethylazanium Traditional Name: [5-(3,5-dicarbomethoxyphenyl)-2-furyl]methyl-phenethyl-ammonium Formula: C23H24NO5+ MolecularWeight: 394.44036

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C2=CC=C(O2)C[NH2+]CCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C2=CC=C(O2)C[NH2+]CCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C23H23NO5/c1-27-22(25)18-12-17(13-19(14-18)23(26)28-2)21-9-8-20(29-21)15-24-11-10-16-6-4-3-5-7-16/h3-9,12-14,24H,10-11,15H2,1-2H3/p+1