2-(4-chloranyl-2,6-dimethyl-phenoxy)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]ethanamide

Systemtic Name: 2-(4-chloranyl-2,6-dimethyl-phenoxy)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]ethanamide Openeye Name: 2-(4-chloro-2,6-dimethyl-phenoxy)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]acetamide CAS Name: 2-(4-chloro-2,6-dimethylphenoxy)-N-[(1S)-2-(4-morpholin-4-iumyl)-1-phenylethyl]acetamide IUPAC Name: 2-(4-chloro-2,6-dimethylphenoxy)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenylethyl]acetamide Traditional Name: 2-(4-chloro-2,6-dimethyl-phenoxy)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]acetamide Formula: C22H28ClN2O3+ MolecularWeight: 403.92232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC(C[NH+]2CCOCC2)C3=CC=CC=C3)C)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)N[C@H](C[NH+]2CCOCC2)C3=CC=CC=C3)C)Cl

InChI

InChI=1S/C22H27ClN2O3/c1-16-12-19(23)13-17(2)22(16)28-15-21(26)24-20(18-6-4-3-5-7-18)14-25-8-10-27-11-9-25/h3-7,12-13,20H,8-11,14-15H2,1-2H3,(H,24,26)/p+1/t20-/m1/s1