(2-bromanyl-4,5-diethoxy-phenyl)methyl-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (2-bromanyl-4,5-diethoxy-phenyl)methyl-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (2-bromo-4,5-diethoxy-phenyl)methyl-[2-(cyclopropylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (2-bromo-4,5-diethoxyphenyl)methyl-[2-(cyclopropylamino)-2-oxoethyl]-methylammonium IUPAC Name: (2-bromo-4,5-diethoxyphenyl)methyl-[2-(cyclopropylamino)-2-oxoethyl]-methylazanium Traditional Name: (2-bromo-4,5-diethoxy-benzyl)-[2-(cyclopropylamino)-2-keto-ethyl]-methyl-ammonium Formula: C17H26BrN2O3+ MolecularWeight: 386.30394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C[NH+](C)CC(=O)NC2CC2)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C[NH+](C)CC(=O)NC2CC2)Br)OCC

InChI

InChI=1S/C17H25BrN2O3/c1-4-22-15-8-12(14(18)9-16(15)23-5-2)10-20(3)11-17(21)19-13-6-7-13/h8-9,13H,4-7,10-11H2,1-3H3,(H,19,21)/p+1