5-methyl-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]pyrazine-2-carboxamide

Systemtic Name: 5-methyl-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]pyrazine-2-carboxamide Openeye Name: 5-methyl-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]pyrazine-2-carboxamide CAS Name: 5-methyl-N-[[2-(1-pyrrolidinyl)-4-pyridin-1-iumyl]methyl]-2-pyrazinecarboxamide IUPAC Name: 5-methyl-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]pyrazine-2-carboxamide Traditional Name: 5-methyl-N-[(2-pyrrolidinopyridin-1-ium-4-yl)methyl]pyrazinamide Formula: C16H20N5O+ MolecularWeight: 298.3629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)NCC2=CC(=[NH+]C=C2)N3CCCC3

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)NCC2=CC(=[NH+]C=C2)N3CCCC3

InChI

InChI=1S/C16H19N5O/c1-12-9-19-14(11-18-12)16(22)20-10-13-4-5-17-15(8-13)21-6-2-3-7-21/h4-5,8-9,11H,2-3,6-7,10H2,1H3,(H,20,22)/p+1