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

Systemtic Name: [5-[2-(3,4-dimethoxyphenyl)ethyl-methyl-carbamoyl]furan-2-yl]methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[5-[2-(3,4-dimethoxyphenyl)ethyl-methyl-carbamoyl]-2-furyl]methyl]-methyl-ammonium CAS Name: [5-[[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-oxomethyl]-2-furanyl]methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[5-[2-(3,4-dimethoxyphenyl)ethyl-methylcarbamoyl]furan-2-yl]methyl]-methylazanium Traditional Name: benzyl-[[5-[homoveratryl(methyl)carbamoyl]-2-furyl]methyl]-methyl-ammonium Formula: C25H31N2O4+ MolecularWeight: 423.52464

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC2=CC=C(O2)C(=O)N(C)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC2=CC=C(O2)C(=O)N(C)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C25H30N2O4/c1-26(17-20-8-6-5-7-9-20)18-21-11-13-23(31-21)25(28)27(2)15-14-19-10-12-22(29-3)24(16-19)30-4/h5-13,16H,14-15,17-18H2,1-4H3/p+1