1-[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]-N-(2-pyrazin-2-ylethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]-N-(2-pyrazin-2-ylethyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[1-(o-tolylmethyl)piperidin-1-ium-4-yl]-N-(2-pyrazin-2-ylethyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[1-[(2-methylphenyl)methyl]-4-piperidin-1-iumyl]-N-[2-(2-pyrazinyl)ethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]-N-(2-pyrazin-2-ylethyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-[1-(2-methylbenzyl)piperidin-1-ium-4-yl]-N-(2-pyrazin-2-ylethyl)piperidin-1-ium-4-carboxamide Formula: C25H37N5O+2 MolecularWeight: 423.59418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCC(CC2)[NH+]3CCC(CC3)C(=O)NCCC4=NC=CN=C4

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCC(CC2)[NH+]3CCC(CC3)C(=O)NCCC4=NC=CN=C4

InChI

InChI=1S/C25H35N5O/c1-20-4-2-3-5-22(20)19-29-14-9-24(10-15-29)30-16-7-21(8-17-30)25(31)28-11-6-23-18-26-12-13-27-23/h2-5,12-13,18,21,24H,6-11,14-17,19H2,1H3,(H,28,31)/p+2