(E)-2-(1-methylpyridin-1-ium-4-yl)-1-morpholin-4-yl-3-phenyl-prop-2-en-1-one iodide

Systemtic Name: (E)-2-(1-methylpyridin-1-ium-4-yl)-1-morpholin-4-yl-3-phenyl-prop-2-en-1-one iodide Openeye Name: (E)-2-(1-methylpyridin-1-ium-4-yl)-1-morpholino-3-phenyl-prop-2-en-1-one iodide CAS Name: (E)-2-(1-methyl-4-pyridin-1-iumyl)-1-(4-morpholinyl)-3-phenyl-2-propen-1-one iodide IUPAC Name: (E)-2-(1-methylpyridin-1-ium-4-yl)-1-morpholin-4-yl-3-phenylprop-2-en-1-one iodide Traditional Name: (E)-2-(1-methylpyridin-1-ium-4-yl)-1-morpholino-3-phenyl-prop-2-en-1-one iodide Formula: C19H21IN2O2 MolecularWeight: 436.28671

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C(=CC2=CC=CC=C2)C(=O)N3CCOCC3.[I-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)/C(=C\C2=CC=CC=C2)/C(=O)N3CCOCC3.[I-]

InChI

InChI=1S/C19H21N2O2.HI/c1-20-9-7-17(8-10-20)18(15-16-5-3-2-4-6-16)19(22)21-11-13-23-14-12-21;/h2-10,15H,11-14H2,1H3;1H/q+1;/p-1/b18-15+;