2-(2-cyanophenoxy)-N-[[(2S)-4-(phenylmethyl)morpholin-4-ium-2-yl]methyl]ethanamide

Systemtic Name: 2-(2-cyanophenoxy)-N-[[(2S)-4-(phenylmethyl)morpholin-4-ium-2-yl]methyl]ethanamide Openeye Name: N-[[(2S)-4-benzylmorpholin-4-ium-2-yl]methyl]-2-(2-cyanophenoxy)acetamide CAS Name: 2-(2-cyanophenoxy)-N-[[(2S)-4-(phenylmethyl)-2-morpholin-4-iumyl]methyl]acetamide IUPAC Name: N-[[(2S)-4-benzylmorpholin-4-ium-2-yl]methyl]-2-(2-cyanophenoxy)acetamide Traditional Name: N-[[(2S)-4-benzylmorpholin-4-ium-2-yl]methyl]-2-(2-cyanophenoxy)acetamide Formula: C21H24N3O3+ MolecularWeight: 366.43356

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C[NH+]1CC2=CC=CC=C2)CNC(=O)COC3=CC=CC=C3C#N

Isomeric SMILES

C1CO[C@H](C[NH+]1CC2=CC=CC=C2)CNC(=O)COC3=CC=CC=C3C#N

InChI

InChI=1S/C21H23N3O3/c22-12-18-8-4-5-9-20(18)27-16-21(25)23-13-19-15-24(10-11-26-19)14-17-6-2-1-3-7-17/h1-9,19H,10-11,13-16H2,(H,23,25)/p+1/t19-/m0/s1