2-(3,4-dimethylphenoxy)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]ethanamide

Systemtic Name: 2-(3,4-dimethylphenoxy)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]ethanamide Openeye Name: 2-(3,4-dimethylphenoxy)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]acetamide CAS Name: 2-(3,4-dimethylphenoxy)-N-[(1S)-2-(4-morpholin-4-iumyl)-1-phenylethyl]acetamide IUPAC Name: 2-(3,4-dimethylphenoxy)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenylethyl]acetamide Traditional Name: 2-(3,4-dimethylphenoxy)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]acetamide Formula: C22H29N2O3+ MolecularWeight: 369.47726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)NC(C[NH+]2CCOCC2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(=O)N[C@H](C[NH+]2CCOCC2)C3=CC=CC=C3)C

InChI

InChI=1S/C22H28N2O3/c1-17-8-9-20(14-18(17)2)27-16-22(25)23-21(19-6-4-3-5-7-19)15-24-10-12-26-13-11-24/h3-9,14,21H,10-13,15-16H2,1-2H3,(H,23,25)/p+1/t21-/m1/s1