(5-bromanyl-2-methoxy-phenyl)methyl-methyl-[(2R)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl-methyl-[(2R)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: (5-bromo-2-methoxy-phenyl)methyl-methyl-[(1R)-1-methyl-2-(methylcarbamoylamino)-2-oxo-ethyl]ammonium CAS Name: (5-bromo-2-methoxyphenyl)methyl-methyl-[(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl]ammonium IUPAC Name: (5-bromo-2-methoxyphenyl)methyl-methyl-[(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl]azanium Traditional Name: (5-bromo-2-methoxy-benzyl)-[(1R)-2-keto-1-methyl-2-(methylcarbamoylamino)ethyl]-methyl-ammonium Formula: C14H21BrN3O3+ MolecularWeight: 359.23884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC)[NH+](C)CC1=C(C=CC(=C1)Br)OC

InChI

InChI=1S/C14H20BrN3O3/c1-9(13(19)17-14(20)16-2)18(3)8-10-7-11(15)5-6-12(10)21-4/h5-7,9H,8H2,1-4H3,(H2,16,17,19,20)/p+1/t9-/m1/s1