2-[(E)-3-ethoxy-3-oxidanyl-1-pyridin-1-ium-1-yl-prop-1-en-2-yl]-2-oxidanyl-indene-1,3-dione

Systemtic Name: 2-[(E)-3-ethoxy-3-oxidanyl-1-pyridin-1-ium-1-yl-prop-1-en-2-yl]-2-oxidanyl-indene-1,3-dione Openeye Name: 2-[(E)-1-[ethoxy(hydroxy)methyl]-2-pyridin-1-ium-1-yl-vinyl]-2-hydroxy-indane-1,3-dione CAS Name: 2-[(E)-3-ethoxy-3-hydroxy-1-(1-pyridin-1-iumyl)prop-1-en-2-yl]-2-hydroxyindene-1,3-dione IUPAC Name: 2-[(E)-3-ethoxy-3-hydroxy-1-pyridin-1-ium-1-ylprop-1-en-2-yl]-2-hydroxyindene-1,3-dione Traditional Name: 2-[(E)-1-[ethoxy(hydroxy)methyl]-2-pyridin-1-ium-1-yl-vinyl]-2-hydroxy-indane-1,3-quinone Formula: C19H18NO5+ MolecularWeight: 340.34992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(=C[N+]1=CC=CC=C1)C2(C(=O)C3=CC=CC=C3C2=O)O)O

Isomeric SMILES

CCOC(/C(=C/[N+]1=CC=CC=C1)/C2(C(=O)C3=CC=CC=C3C2=O)O)O

InChI

InChI=1S/C19H18NO5/c1-2-25-18(23)15(12-20-10-6-3-7-11-20)19(24)16(21)13-8-4-5-9-14(13)17(19)22/h3-12,18,23-24H,2H2,1H3/q+1/b15-12-