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

Systemtic Name: 2-(4-methoxyphenyl)ethyl-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]azanium Openeye Name: 2-(4-methoxyphenyl)ethyl-[(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]ammonium CAS Name: 2-(4-methoxyphenyl)ethyl-[(2S)-1-oxo-1-(propylamino)propan-2-yl]ammonium IUPAC Name: 2-(4-methoxyphenyl)ethyl-[(2S)-1-oxo-1-(propylamino)propan-2-yl]azanium Traditional Name: [(1S)-2-keto-1-methyl-2-(propylamino)ethyl]-[2-(4-methoxyphenyl)ethyl]ammonium Formula: C15H25N2O2+ MolecularWeight: 265.3712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N2O2/c1-4-10-17-15(18)12(2)16-11-9-13-5-7-14(19-3)8-6-13/h5-8,12,16H,4,9-11H2,1-3H3,(H,17,18)/p+1/t12-/m0/s1