dimethyl-[[4-[[2-(4-phenylmethoxyphenoxy)ethanoylamino]methyl]phenyl]methyl]azanium

Systemtic Name: dimethyl-[[4-[[2-(4-phenylmethoxyphenoxy)ethanoylamino]methyl]phenyl]methyl]azanium Openeye Name: [4-[[[2-(4-benzyloxyphenoxy)acetyl]amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: dimethyl-[[4-[[[1-oxo-2-(4-phenylmethoxyphenoxy)ethyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: dimethyl-[[4-[[[2-(4-phenylmethoxyphenoxy)acetyl]amino]methyl]phenyl]methyl]azanium Traditional Name: [4-[[[2-(4-benzoxyphenoxy)acetyl]amino]methyl]benzyl]-dimethyl-ammonium Formula: C25H29N2O3+ MolecularWeight: 405.50936

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)COC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)COC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C25H28N2O3/c1-27(2)17-21-10-8-20(9-11-21)16-26-25(28)19-30-24-14-12-23(13-15-24)29-18-22-6-4-3-5-7-22/h3-15H,16-19H2,1-2H3,(H,26,28)/p+1