[4-[[2-(4-chloranyl-2,6-dimethyl-phenoxy)ethanoylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [4-[[2-(4-chloranyl-2,6-dimethyl-phenoxy)ethanoylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [4-[[[2-(4-chloro-2,6-dimethyl-phenoxy)acetyl]amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [4-[[[2-(4-chloro-2,6-dimethylphenoxy)-1-oxoethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [4-[[[2-(4-chloro-2,6-dimethylphenoxy)acetyl]amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [4-[[[2-(4-chloro-2,6-dimethyl-phenoxy)acetyl]amino]methyl]benzyl]-dimethyl-ammonium Formula: C20H26ClN2O2+ MolecularWeight: 361.88564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NCC2=CC=C(C=C2)C[NH+](C)C)C)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NCC2=CC=C(C=C2)C[NH+](C)C)C)Cl

InChI

InChI=1S/C20H25ClN2O2/c1-14-9-18(21)10-15(2)20(14)25-13-19(24)22-11-16-5-7-17(8-6-16)12-23(3)4/h5-10H,11-13H2,1-4H3,(H,22,24)/p+1