[4-[[(3-bromanyl-4-methoxy-phenyl)carbonylamino]methyl]phenyl]methyl-diethyl-azanium

Systemtic Name: [4-[[(3-bromanyl-4-methoxy-phenyl)carbonylamino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [4-[[(3-bromo-4-methoxy-benzoyl)amino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [4-[[[(3-bromo-4-methoxyphenyl)-oxomethyl]amino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [4-[[(3-bromo-4-methoxybenzoyl)amino]methyl]phenyl]methyl-diethylazanium Traditional Name: [4-[[(3-bromo-4-methoxy-benzoyl)amino]methyl]benzyl]-diethyl-ammonium Formula: C20H26BrN2O2+ MolecularWeight: 406.33664

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C20H25BrN2O2/c1-4-23(5-2)14-16-8-6-15(7-9-16)13-22-20(24)17-10-11-19(25-3)18(21)12-17/h6-12H,4-5,13-14H2,1-3H3,(H,22,24)/p+1