2-(4-methoxyphenyl)ethyl-[(2S)-1-(methylamino)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: 2-(4-methoxyphenyl)ethyl-[(2S)-1-(methylamino)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: 2-(4-methoxyphenyl)ethyl-[(1S)-1-methyl-2-(methylamino)-2-oxo-ethyl]ammonium CAS Name: 2-(4-methoxyphenyl)ethyl-[(2S)-1-(methylamino)-1-oxopropan-2-yl]ammonium IUPAC Name: 2-(4-methoxyphenyl)ethyl-[(2S)-1-(methylamino)-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-keto-1-methyl-2-(methylamino)ethyl]-[2-(4-methoxyphenyl)ethyl]ammonium Formula: C13H21N2O2+ MolecularWeight: 237.31804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC)[NH2+]CCC1=CC=C(C=C1)OC

Isomeric SMILES

C[C@@H](C(=O)NC)[NH2+]CCC1=CC=C(C=C1)OC

InChI

InChI=1S/C13H20N2O2/c1-10(13(16)14-2)15-9-8-11-4-6-12(17-3)7-5-11/h4-7,10,15H,8-9H2,1-3H3,(H,14,16)/p+1/t10-/m0/s1