4-cyano-N-[3-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]propyl]benzamide

Systemtic Name: 4-cyano-N-[3-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]propyl]benzamide Openeye Name: 4-cyano-N-[3-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]propyl]benzamide CAS Name: 4-cyano-N-[3-[(2S,6S)-2,6-dimethyl-4-morpholin-4-iumyl]propyl]benzamide IUPAC Name: 4-cyano-N-[3-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]propyl]benzamide Traditional Name: 4-cyano-N-[3-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]propyl]benzamide Formula: C17H24N3O2+ MolecularWeight: 302.39136

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)CCCNC(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

C[C@H]1C[NH+](C[C@@H](O1)C)CCCNC(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H23N3O2/c1-13-11-20(12-14(2)22-13)9-3-8-19-17(21)16-6-4-15(10-18)5-7-16/h4-7,13-14H,3,8-9,11-12H2,1-2H3,(H,19,21)/p+1/t13-,14-/m0/s1