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

Systemtic Name: N-[(5-methylpyrazin-2-yl)methyl]-2-piperidin-1-ium-1-yl-1,3-dihydroindene-2-carboxamide Openeye Name: N-[(5-methylpyrazin-2-yl)methyl]-2-piperidin-1-ium-1-yl-indane-2-carboxamide CAS Name: N-[(5-methyl-2-pyrazinyl)methyl]-2-(1-piperidin-1-iumyl)-1,3-dihydroindene-2-carboxamide IUPAC Name: N-[(5-methylpyrazin-2-yl)methyl]-2-piperidin-1-ium-1-yl-1,3-dihydroindene-2-carboxamide Traditional Name: N-[(5-methylpyrazin-2-yl)methyl]-2-piperidin-1-ium-1-yl-indane-2-carboxamide Formula: C21H27N4O+ MolecularWeight: 351.46528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=N1)CNC(=O)C2(CC3=CC=CC=C3C2)[NH+]4CCCCC4

Isomeric SMILES

CC1=CN=C(C=N1)CNC(=O)C2(CC3=CC=CC=C3C2)[NH+]4CCCCC4

InChI

InChI=1S/C21H26N4O/c1-16-13-23-19(14-22-16)15-24-20(26)21(25-9-5-2-6-10-25)11-17-7-3-4-8-18(17)12-21/h3-4,7-8,13-14H,2,5-6,9-12,15H2,1H3,(H,24,26)/p+1