N'-(2-methylpropyl)-N-[2-[(2R)-2-phenylmorpholin-4-ium-4-yl]ethyl]ethanediamide

Systemtic Name: N'-(2-methylpropyl)-N-[2-[(2R)-2-phenylmorpholin-4-ium-4-yl]ethyl]ethanediamide Openeye Name: N'-isobutyl-N-[2-[(2R)-2-phenylmorpholin-4-ium-4-yl]ethyl]oxamide CAS Name: N'-(2-methylpropyl)-N-[2-[(2R)-2-phenyl-4-morpholin-4-iumyl]ethyl]oxamide IUPAC Name: N'-(2-methylpropyl)-N-[2-[(2R)-2-phenylmorpholin-4-ium-4-yl]ethyl]oxamide Traditional Name: N'-isobutyl-N-[2-[(2R)-2-phenylmorpholin-4-ium-4-yl]ethyl]oxamide Formula: C18H28N3O3+ MolecularWeight: 334.43322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(=O)NCC[NH+]1CCOC(C1)C2=CC=CC=C2

Isomeric SMILES

CC(C)CNC(=O)C(=O)NCC[NH+]1CCO[C@@H](C1)C2=CC=CC=C2

InChI

InChI=1S/C18H27N3O3/c1-14(2)12-20-18(23)17(22)19-8-9-21-10-11-24-16(13-21)15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H,19,22)(H,20,23)/p+1/t16-/m0/s1