[(1R)-2-[[(2S)-2-azaniumylpropanoyl]amino]-1-(3-methoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[[(2S)-2-azaniumylpropanoyl]amino]-1-(3-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[[(2S)-2-azaniumylpropanoyl]amino]-1-(3-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[(2S)-2-ammonio-1-oxopropyl]amino]-1-(3-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1R)-2-[[(2S)-2-azaniumylpropanoyl]amino]-1-(3-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1R)-2-[[(2S)-2-ammoniopropanoyl]amino]-1-(3-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C14H25N3O2+2 MolecularWeight: 267.3672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC(C1=CC(=CC=C1)OC)[NH+](C)C)[NH3+]

Isomeric SMILES

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

InChI

InChI=1S/C14H23N3O2/c1-10(15)14(18)16-9-13(17(2)3)11-6-5-7-12(8-11)19-4/h5-8,10,13H,9,15H2,1-4H3,(H,16,18)/p+2/t10-,13-/m0/s1