2-[[(2S)-2-(4-ethanoylphenoxy)propanoyl]amino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[(2S)-2-(4-ethanoylphenoxy)propanoyl]amino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[(2S)-2-(4-acetylphenoxy)propanoyl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[(2S)-2-(4-acetylphenoxy)-1-oxopropyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[(2S)-2-(4-acetylphenoxy)propanoyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[(2S)-2-(4-acetylphenoxy)propanoyl]amino]ethyl-diisopropyl-ammonium Formula: C19H31N2O3+ MolecularWeight: 335.46104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=O)C(C)OC1=CC=C(C=C1)C(=O)C)C(C)C

Isomeric SMILES

C[C@@H](C(=O)NCC[NH+](C(C)C)C(C)C)OC1=CC=C(C=C1)C(=O)C

InChI

InChI=1S/C19H30N2O3/c1-13(2)21(14(3)4)12-11-20-19(23)16(6)24-18-9-7-17(8-10-18)15(5)22/h7-10,13-14,16H,11-12H2,1-6H3,(H,20,23)/p+1/t16-/m0/s1