2-piperidin-1-ium-1-yl-N-(2-pyrazin-2-ylethyl)-1,3-dihydroindene-2-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2(CC3=CC=CC=C3C2)C(=O)NCCC4=NC=CN=C4

Isomeric SMILES

C1CC[NH+](CC1)C2(CC3=CC=CC=C3C2)C(=O)NCCC4=NC=CN=C4

InChI

InChI=1S/C21H26N4O/c26-20(24-9-8-19-16-22-10-11-23-19)21(25-12-4-1-5-13-25)14-17-6-2-3-7-18(17)15-21/h2-3,6-7,10-11,16H,1,4-5,8-9,12-15H2,(H,24,26)/p+1