8-(furan-2-yl)-3,3-dimethyl-6-(2-piperidin-1-ium-1-ylethoxy)-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile

Systemtic Name: 8-(furan-2-yl)-3,3-dimethyl-6-(2-piperidin-1-ium-1-ylethoxy)-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile Openeye Name: 8-(2-furyl)-3,3-dimethyl-6-(2-piperidin-1-ium-1-ylethoxy)-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile CAS Name: 8-(2-furanyl)-3,3-dimethyl-6-[2-(1-piperidin-1-iumyl)ethoxy]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile IUPAC Name: 8-(furan-2-yl)-3,3-dimethyl-6-(2-piperidin-1-ium-1-ylethoxy)-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile Traditional Name: 8-(2-furyl)-3,3-dimethyl-6-(2-piperidin-1-ium-1-ylethoxy)-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=NC(=C2CO1)C3=CC=CO3)OCC[NH+]4CCCCC4)C#N)C

Isomeric SMILES

CC1(CC2=C(C(=NC(=C2CO1)C3=CC=CO3)OCC[NH+]4CCCCC4)C#N)C

InChI

InChI=1S/C22H27N3O3/c1-22(2)13-16-17(14-23)21(27-12-10-25-8-4-3-5-9-25)24-20(18(16)15-28-22)19-7-6-11-26-19/h6-7,11H,3-5,8-10,12-13,15H2,1-2H3/p+1