2-(4-chloranylphenoxy)ethyl-methyl-[2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl]azanium

Systemtic Name: 2-(4-chloranylphenoxy)ethyl-methyl-[2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl]azanium Openeye Name: 2-(4-chlorophenoxy)ethyl-methyl-[2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl]ammonium CAS Name: 2-(4-chlorophenoxy)ethyl-methyl-[2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl]ammonium IUPAC Name: 2-(4-chlorophenoxy)ethyl-methyl-[2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl]azanium Traditional Name: 2-(4-chlorophenoxy)ethyl-[2-keto-2-[[(2S)-2-phenylpropyl]amino]ethyl]-methyl-ammonium Formula: C20H26ClN2O2+ MolecularWeight: 361.88564

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C[NH+](C)CCOC1=CC=C(C=C1)Cl)C2=CC=CC=C2

Isomeric SMILES

C[C@H](CNC(=O)C[NH+](C)CCOC1=CC=C(C=C1)Cl)C2=CC=CC=C2

InChI

InChI=1S/C20H25ClN2O2/c1-16(17-6-4-3-5-7-17)14-22-20(24)15-23(2)12-13-25-19-10-8-18(21)9-11-19/h3-11,16H,12-15H2,1-2H3,(H,22,24)/p+1/t16-/m1/s1