5-methyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]pyrazine-2-carboxamide

Systemtic Name: 5-methyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]pyrazine-2-carboxamide Openeye Name: 5-methyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]pyrazine-2-carboxamide CAS Name: 5-methyl-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]-2-pyrazinecarboxamide IUPAC Name: 5-methyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]pyrazine-2-carboxamide Traditional Name: 5-methyl-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]pyrazinamide Formula: C19H25N4O+ MolecularWeight: 325.428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)NCC2=CC=CC=C2C[NH+]3CCCCC3

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)NCC2=CC=CC=C2C[NH+]3CCCCC3

InChI

InChI=1S/C19H24N4O/c1-15-11-21-18(13-20-15)19(24)22-12-16-7-3-4-8-17(16)14-23-9-5-2-6-10-23/h3-4,7-8,11,13H,2,5-6,9-10,12,14H2,1H3,(H,22,24)/p+1