2-(4-bromanylphenoxy)ethyl-[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 2-(4-bromanylphenoxy)ethyl-[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 2-(4-bromophenoxy)ethyl-[2-(tert-butylcarbamoylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: 2-(4-bromophenoxy)ethyl-[2-[[(tert-butylamino)-oxomethyl]amino]-2-oxoethyl]-methylammonium IUPAC Name: 2-(4-bromophenoxy)ethyl-[2-(tert-butylcarbamoylamino)-2-oxoethyl]-methylazanium Traditional Name: 2-(4-bromophenoxy)ethyl-[2-(tert-butylcarbamoylamino)-2-keto-ethyl]-methyl-ammonium Formula: C16H25BrN3O3+ MolecularWeight: 387.292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24BrN3O3/c1-16(2,3)19-15(22)18-14(21)11-20(4)9-10-23-13-7-5-12(17)6-8-13/h5-8H,9-11H2,1-4H3,(H2,18,19,21,22)/p+1