[4-[[2-(2-chloranyl-5-methyl-phenoxy)ethanoylamino]methyl]phenyl]methyl-diethyl-azanium

Systemtic Name: [4-[[2-(2-chloranyl-5-methyl-phenoxy)ethanoylamino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [4-[[[2-(2-chloro-5-methyl-phenoxy)acetyl]amino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [4-[[[2-(2-chloro-5-methylphenoxy)-1-oxoethyl]amino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [4-[[[2-(2-chloro-5-methylphenoxy)acetyl]amino]methyl]phenyl]methyl-diethylazanium Traditional Name: [4-[[[2-(2-chloro-5-methyl-phenoxy)acetyl]amino]methyl]benzyl]-diethyl-ammonium Formula: C21H28ClN2O2+ MolecularWeight: 375.91222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27ClN2O2/c1-4-24(5-2)14-18-9-7-17(8-10-18)13-23-21(25)15-26-20-12-16(3)6-11-19(20)22/h6-12H,4-5,13-15H2,1-3H3,(H,23,25)/p+1