[4-[2-(3,5-dimethylphenoxy)ethanoylamino]phenyl]methyl-diethyl-azanium

Systemtic Name: [4-[2-(3,5-dimethylphenoxy)ethanoylamino]phenyl]methyl-diethyl-azanium Openeye Name: [4-[[2-(3,5-dimethylphenoxy)acetyl]amino]phenyl]methyl-diethyl-ammonium CAS Name: [4-[[2-(3,5-dimethylphenoxy)-1-oxoethyl]amino]phenyl]methyl-diethylammonium IUPAC Name: [4-[[2-(3,5-dimethylphenoxy)acetyl]amino]phenyl]methyl-diethylazanium Traditional Name: [4-[[2-(3,5-dimethylphenoxy)acetyl]amino]benzyl]-diethyl-ammonium Formula: C21H29N2O2+ MolecularWeight: 341.46716

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)NC(=O)COC2=CC(=CC(=C2)C)C

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)NC(=O)COC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C21H28N2O2/c1-5-23(6-2)14-18-7-9-19(10-8-18)22-21(24)15-25-20-12-16(3)11-17(4)13-20/h7-13H,5-6,14-15H2,1-4H3,(H,22,24)/p+1