2-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(3-bromo-4-ethoxy-5-methoxy-benzoyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(3-bromo-4-ethoxy-5-methoxyphenyl)-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(3-bromo-4-ethoxy-5-methoxybenzoyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(3-bromo-4-ethoxy-5-methoxy-benzoyl)amino]ethyl-dimethyl-ammonium Formula: C14H22BrN2O3+ MolecularWeight: 346.24008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)NCC[NH+](C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)NCC[NH+](C)C)OC

InChI

InChI=1S/C14H21BrN2O3/c1-5-20-13-11(15)8-10(9-12(13)19-4)14(18)16-6-7-17(2)3/h8-9H,5-7H2,1-4H3,(H,16,18)/p+1