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

Systemtic Name: 2-(2-bromanyl-4-chloranyl-phenoxy)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]ethanamide Openeye Name: 2-(2-bromo-4-chloro-phenoxy)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]acetamide CAS Name: 2-(2-bromo-4-chlorophenoxy)-N-[(1S)-2-(4-morpholin-4-iumyl)-1-phenylethyl]acetamide IUPAC Name: 2-(2-bromo-4-chlorophenoxy)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenylethyl]acetamide Traditional Name: 2-(2-bromo-4-chloro-phenoxy)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]acetamide Formula: C20H23BrClN2O3+ MolecularWeight: 454.76522

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(C2=CC=CC=C2)NC(=O)COC3=C(C=C(C=C3)Cl)Br

Isomeric SMILES

C1COCC[NH+]1C[C@H](C2=CC=CC=C2)NC(=O)COC3=C(C=C(C=C3)Cl)Br

InChI

InChI=1S/C20H22BrClN2O3/c21-17-12-16(22)6-7-19(17)27-14-20(25)23-18(15-4-2-1-3-5-15)13-24-8-10-26-11-9-24/h1-7,12,18H,8-11,13-14H2,(H,23,25)/p+1/t18-/m1/s1