2-[3-[[furan-2-ylcarbonyl(pyridin-2-ylmethyl)amino]methyl]phenoxy]ethyl-dimethyl-azanium

Systemtic Name: 2-[3-[[furan-2-ylcarbonyl(pyridin-2-ylmethyl)amino]methyl]phenoxy]ethyl-dimethyl-azanium Openeye Name: 2-[3-[[furan-2-carbonyl(2-pyridylmethyl)amino]methyl]phenoxy]ethyl-dimethyl-ammonium CAS Name: 2-[3-[[[2-furanyl(oxo)methyl]-(2-pyridinylmethyl)amino]methyl]phenoxy]ethyl-dimethylammonium IUPAC Name: 2-[3-[[furan-2-carbonyl(pyridin-2-ylmethyl)amino]methyl]phenoxy]ethyl-dimethylazanium Traditional Name: 2-[3-[[2-furoyl(2-pyridylmethyl)amino]methyl]phenoxy]ethyl-dimethyl-ammonium Formula: C22H26N3O3+ MolecularWeight: 380.46014

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCOC1=CC=CC(=C1)CN(CC2=CC=CC=N2)C(=O)C3=CC=CO3

Isomeric SMILES

C[NH+](C)CCOC1=CC=CC(=C1)CN(CC2=CC=CC=N2)C(=O)C3=CC=CO3

InChI

InChI=1S/C22H25N3O3/c1-24(2)12-14-27-20-9-5-7-18(15-20)16-25(17-19-8-3-4-11-23-19)22(26)21-10-6-13-28-21/h3-11,13,15H,12,14,16-17H2,1-2H3/p+1