2-(4-bromanylphenoxy)ethyl-methyl-[(1S)-2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]azanium

Systemtic Name: 2-(4-bromanylphenoxy)ethyl-methyl-[(1S)-2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]azanium Openeye Name: 2-(4-bromophenoxy)ethyl-methyl-[(1S)-2-(methylcarbamoylamino)-2-oxo-1-phenyl-ethyl]ammonium CAS Name: 2-(4-bromophenoxy)ethyl-methyl-[(1S)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl]ammonium IUPAC Name: 2-(4-bromophenoxy)ethyl-methyl-[(1S)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl]azanium Traditional Name: 2-(4-bromophenoxy)ethyl-[(1S)-2-keto-2-(methylcarbamoylamino)-1-phenyl-ethyl]-methyl-ammonium Formula: C19H23BrN3O3+ MolecularWeight: 421.30822

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)C(C1=CC=CC=C1)[NH+](C)CCOC2=CC=C(C=C2)Br

Isomeric SMILES

CNC(=O)NC(=O)[C@H](C1=CC=CC=C1)[NH+](C)CCOC2=CC=C(C=C2)Br

InChI

InChI=1S/C19H22BrN3O3/c1-21-19(25)22-18(24)17(14-6-4-3-5-7-14)23(2)12-13-26-16-10-8-15(20)9-11-16/h3-11,17H,12-13H2,1-2H3,(H2,21,22,24,25)/p+1/t17-/m0/s1