N-(6-phenoxypyridin-3-yl)-1-[(E)-3-phenylprop-2-enyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(6-phenoxypyridin-3-yl)-1-[(E)-3-phenylprop-2-enyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(E)-cinnamyl]-N-(6-phenoxy-3-pyridyl)piperidin-1-ium-4-carboxamide CAS Name: N-(6-phenoxy-3-pyridinyl)-1-[(E)-3-phenylprop-2-enyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(6-phenoxypyridin-3-yl)-1-[(E)-3-phenylprop-2-enyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(E)-cinnamyl]-N-(6-phenoxy-3-pyridyl)piperidin-1-ium-4-carboxamide Formula: C26H28N3O2+ MolecularWeight: 414.51942

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CN=C(C=C2)OC3=CC=CC=C3)CC=CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CN=C(C=C2)OC3=CC=CC=C3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C26H27N3O2/c30-26(28-23-13-14-25(27-20-23)31-24-11-5-2-6-12-24)22-15-18-29(19-16-22)17-7-10-21-8-3-1-4-9-21/h1-14,20,22H,15-19H2,(H,28,30)/p+1/b10-7+