6-(5-ethyl-2-methyl-pyrazol-3-yl)carbonyl-1-(2-piperidin-1-ium-1-ylethyl)-3-pyridin-4-yl-7,8-dihydro-5H-1,6-naphthyridin-2-one

Systemtic Name: 6-(5-ethyl-2-methyl-pyrazol-3-yl)carbonyl-1-(2-piperidin-1-ium-1-ylethyl)-3-pyridin-4-yl-7,8-dihydro-5H-1,6-naphthyridin-2-one Openeye Name: 6-(5-ethyl-2-methyl-pyrazole-3-carbonyl)-1-(2-piperidin-1-ium-1-ylethyl)-3-(4-pyridyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one CAS Name: 6-[(5-ethyl-2-methyl-3-pyrazolyl)-oxomethyl]-1-[2-(1-piperidin-1-iumyl)ethyl]-3-pyridin-4-yl-7,8-dihydro-5H-1,6-naphthyridin-2-one IUPAC Name: 6-(5-ethyl-2-methylpyrazole-3-carbonyl)-1-(2-piperidin-1-ium-1-ylethyl)-3-pyridin-4-yl-7,8-dihydro-5H-1,6-naphthyridin-2-one Traditional Name: 6-(5-ethyl-2-methyl-pyrazole-3-carbonyl)-1-(2-piperidin-1-ium-1-ylethyl)-3-(4-pyridyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one Formula: C27H35N6O2+ MolecularWeight: 475.6058

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1)C(=O)N2CCC3=C(C2)C=C(C(=O)N3CC[NH+]4CCCCC4)C5=CC=NC=C5)C

Isomeric SMILES

CCC1=NN(C(=C1)C(=O)N2CCC3=C(C2)C=C(C(=O)N3CC[NH+]4CCCCC4)C5=CC=NC=C5)C

InChI

InChI=1S/C27H34N6O2/c1-3-22-18-25(30(2)29-22)27(35)32-14-9-24-21(19-32)17-23(20-7-10-28-11-8-20)26(34)33(24)16-15-31-12-5-4-6-13-31/h7-8,10-11,17-18H,3-6,9,12-16,19H2,1-2H3/p+1