[4-methoxy-3-[(2S)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl]oxy-phenyl]methylazanium

Systemtic Name: [4-methoxy-3-[(2S)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl]oxy-phenyl]methylazanium Openeye Name: [4-methoxy-3-[(1S)-1-methyl-2-(methylcarbamoylamino)-2-oxo-ethoxy]phenyl]methylammonium CAS Name: [4-methoxy-3-[(2S)-1-(methylcarbamoylamino)-1-oxopropan-2-yl]oxyphenyl]methylammonium IUPAC Name: [4-methoxy-3-[(2S)-1-(methylcarbamoylamino)-1-oxopropan-2-yl]oxyphenyl]methylazanium Traditional Name: [3-[(1S)-2-keto-1-methyl-2-(methylcarbamoylamino)ethoxy]-4-methoxy-benzyl]ammonium Formula: C13H20N3O4+ MolecularWeight: 282.3156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)OC1=C(C=CC(=C1)C[NH3+])OC

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC)OC1=C(C=CC(=C1)C[NH3+])OC

InChI

InChI=1S/C13H19N3O4/c1-8(12(17)16-13(18)15-2)20-11-6-9(7-14)4-5-10(11)19-3/h4-6,8H,7,14H2,1-3H3,(H2,15,16,17,18)/p+1/t8-/m0/s1