6-(1,3-benzodioxol-5-ylcarbonyl)-1-(2-piperidin-1-ium-1-ylethyl)-3-pyridin-4-yl-7,8-dihydro-5H-1,6-naphthyridin-2-one

Systemtic Name: 6-(1,3-benzodioxol-5-ylcarbonyl)-1-(2-piperidin-1-ium-1-ylethyl)-3-pyridin-4-yl-7,8-dihydro-5H-1,6-naphthyridin-2-one Openeye Name: 6-(1,3-benzodioxole-5-carbonyl)-1-(2-piperidin-1-ium-1-ylethyl)-3-(4-pyridyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one CAS Name: 6-[1,3-benzodioxol-5-yl(oxo)methyl]-1-[2-(1-piperidin-1-iumyl)ethyl]-3-pyridin-4-yl-7,8-dihydro-5H-1,6-naphthyridin-2-one IUPAC Name: 6-(1,3-benzodioxole-5-carbonyl)-1-(2-piperidin-1-ium-1-ylethyl)-3-pyridin-4-yl-7,8-dihydro-5H-1,6-naphthyridin-2-one Traditional Name: 1-(2-piperidin-1-ium-1-ylethyl)-6-piperonyloyl-3-(4-pyridyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one Formula: C28H31N4O4+ MolecularWeight: 487.57014

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCN2C3=C(CN(CC3)C(=O)C4=CC5=C(C=C4)OCO5)C=C(C2=O)C6=CC=NC=C6

Isomeric SMILES

C1CC[NH+](CC1)CCN2C3=C(CN(CC3)C(=O)C4=CC5=C(C=C4)OCO5)C=C(C2=O)C6=CC=NC=C6

InChI

InChI=1S/C28H30N4O4/c33-27(21-4-5-25-26(17-21)36-19-35-25)31-13-8-24-22(18-31)16-23(20-6-9-29-10-7-20)28(34)32(24)15-14-30-11-2-1-3-12-30/h4-7,9-10,16-17H,1-3,8,11-15,18-19H2/p+1