N-(cyanomethyl)-2-[4-(1,2,3,6-tetrahydropyridin-1-ium-4-yl)phenoxy]ethanamide

Systemtic Name: N-(cyanomethyl)-2-[4-(1,2,3,6-tetrahydropyridin-1-ium-4-yl)phenoxy]ethanamide Openeye Name: N-(cyanomethyl)-2-[4-(1,2,3,6-tetrahydropyridin-1-ium-4-yl)phenoxy]acetamide CAS Name: N-(cyanomethyl)-2-[4-(1,2,3,6-tetrahydropyridin-1-ium-4-yl)phenoxy]acetamide IUPAC Name: N-(cyanomethyl)-2-[4-(1,2,3,6-tetrahydropyridin-1-ium-4-yl)phenoxy]acetamide Traditional Name: N-(cyanomethyl)-2-[4-(1,2,3,6-tetrahydropyridin-1-ium-4-yl)phenoxy]acetamide Formula: C15H18N3O2+ MolecularWeight: 272.32232

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CC=C1C2=CC=C(C=C2)OCC(=O)NCC#N

Isomeric SMILES

C1C[NH2+]CC=C1C2=CC=C(C=C2)OCC(=O)NCC#N

InChI

InChI=1S/C15H17N3O2/c16-7-10-18-15(19)11-20-14-3-1-12(2-4-14)13-5-8-17-9-6-13/h1-5,17H,6,8-11H2,(H,18,19)/p+1