ethyl 2-[4-(1-phenacylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-(1-phenacylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]ethanoate Openeye Name: ethyl 2-[4-(1-phenacylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]acetate CAS Name: 2-[4-(1-phenacyl-4-pyridin-1-iumyl)-1-pyridin-1-iumyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(1-phenacylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]acetate Traditional Name: 2-[4-(1-phenacylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]acetic acid ethyl ester Formula: C22H22N2O3+2 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)CC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)CC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O3/c1-2-27-22(26)17-24-14-10-19(11-15-24)18-8-12-23(13-9-18)16-21(25)20-6-4-3-5-7-20/h3-15H,2,16-17H2,1H3/q+2