3-(1,3-benzodioxol-5-yl)-N-(4,6-dimethylpyridin-1-ium-2-yl)prop-2-enamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(4,6-dimethylpyridin-1-ium-2-yl)prop-2-enamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-(4,6-dimethylpyridin-1-ium-2-yl)prop-2-enamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-(4,6-dimethyl-2-pyridin-1-iumyl)-2-propenamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(4,6-dimethylpyridin-1-ium-2-yl)prop-2-enamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(4,6-dimethylpyridin-1-ium-2-yl)acrylamide Formula: C17H17N2O3+ MolecularWeight: 297.32848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=C1)NC(=O)C=CC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC1=CC(=[NH+]C(=C1)NC(=O)C=CC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C17H16N2O3/c1-11-7-12(2)18-16(8-11)19-17(20)6-4-13-3-5-14-15(9-13)22-10-21-14/h3-9H,10H2,1-2H3,(H,18,19,20)/p+1