4-pyrazin-2-yl-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-pyrazin-2-yl-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]piperazine-1-carboxamide Openeye Name: 4-pyrazin-2-yl-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]piperazine-1-carboxamide CAS Name: 4-(2-pyrazinyl)-N-[[2-(1-pyrrolidinyl)-4-pyridin-1-iumyl]methyl]-1-piperazinecarboxamide IUPAC Name: 4-pyrazin-2-yl-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]piperazine-1-carboxamide Traditional Name: 4-pyrazin-2-yl-N-[(2-pyrrolidinopyridin-1-ium-4-yl)methyl]piperazine-1-carboxamide Formula: C19H26N7O+ MolecularWeight: 368.45604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=[NH+]C=CC(=C2)CNC(=O)N3CCN(CC3)C4=NC=CN=C4

Isomeric SMILES

C1CCN(C1)C2=[NH+]C=CC(=C2)CNC(=O)N3CCN(CC3)C4=NC=CN=C4

InChI

InChI=1S/C19H25N7O/c27-19(26-11-9-25(10-12-26)18-15-20-5-6-22-18)23-14-16-3-4-21-17(13-16)24-7-1-2-8-24/h3-6,13,15H,1-2,7-12,14H2,(H,23,27)/p+1