N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-2-piperidin-1-ium-1-yl-1,3-dihydroindene-2-carboxamide

Systemtic Name: N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-2-piperidin-1-ium-1-yl-1,3-dihydroindene-2-carboxamide Openeye Name: N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-2-piperidin-1-ium-1-yl-indane-2-carboxamide CAS Name: N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-2-(1-piperidin-1-iumyl)-1,3-dihydroindene-2-carboxamide IUPAC Name: N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-2-piperidin-1-ium-1-yl-1,3-dihydroindene-2-carboxamide Traditional Name: N-methyl-N-[(5-methyl-1H-pyrazol-3-yl)methyl]-2-piperidin-1-ium-1-yl-indane-2-carboxamide Formula: C21H29N4O+ MolecularWeight: 353.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)CN(C)C(=O)C2(CC3=CC=CC=C3C2)[NH+]4CCCCC4

Isomeric SMILES

CC1=CC(=NN1)CN(C)C(=O)C2(CC3=CC=CC=C3C2)[NH+]4CCCCC4

InChI

InChI=1S/C21H28N4O/c1-16-12-19(23-22-16)15-24(2)20(26)21(25-10-6-3-7-11-25)13-17-8-4-5-9-18(17)14-21/h4-5,8-9,12H,3,6-7,10-11,13-15H2,1-2H3,(H,22,23)/p+1