4-cyano-N-[[(2S)-4-(phenylmethyl)morpholin-4-ium-2-yl]methyl]benzamide

Systemtic Name: 4-cyano-N-[[(2S)-4-(phenylmethyl)morpholin-4-ium-2-yl]methyl]benzamide Openeye Name: N-[[(2S)-4-benzylmorpholin-4-ium-2-yl]methyl]-4-cyano-benzamide CAS Name: 4-cyano-N-[[(2S)-4-(phenylmethyl)-2-morpholin-4-iumyl]methyl]benzamide IUPAC Name: N-[[(2S)-4-benzylmorpholin-4-ium-2-yl]methyl]-4-cyanobenzamide Traditional Name: N-[[(2S)-4-benzylmorpholin-4-ium-2-yl]methyl]-4-cyano-benzamide Formula: C20H22N3O2+ MolecularWeight: 336.40758

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C[NH+]1CC2=CC=CC=C2)CNC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CO[C@H](C[NH+]1CC2=CC=CC=C2)CNC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H21N3O2/c21-12-16-6-8-18(9-7-16)20(24)22-13-19-15-23(10-11-25-19)14-17-4-2-1-3-5-17/h1-9,19H,10-11,13-15H2,(H,22,24)/p+1/t19-/m0/s1