2-(3,4-dimethoxyphenyl)ethyl-[[5-(4-ethoxycarbonylphenyl)furan-2-yl]methyl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[[5-(4-ethoxycarbonylphenyl)furan-2-yl]methyl]azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[[5-(4-ethoxycarbonylphenyl)-2-furyl]methyl]ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[[5-(4-ethoxycarbonylphenyl)-2-furanyl]methyl]ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[[5-(4-ethoxycarbonylphenyl)furan-2-yl]methyl]azanium Traditional Name: [5-(4-carbethoxyphenyl)-2-furyl]methyl-homoveratryl-ammonium Formula: C24H28NO5+ MolecularWeight: 410.48282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27NO5/c1-4-29-24(26)19-8-6-18(7-9-19)21-12-10-20(30-21)16-25-14-13-17-5-11-22(27-2)23(15-17)28-3/h5-12,15,25H,4,13-14,16H2,1-3H3/p+1