N-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyrazine-2-carboxamide

Systemtic Name: N-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyrazine-2-carboxamide Openeye Name: N-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyrazine-2-carboxamide CAS Name: N-[(4-phenyl-1-piperazin-1-iumyl)methyl]-2-pyrazinecarboxamide IUPAC Name: N-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyrazine-2-carboxamide Traditional Name: N-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyrazinamide Formula: C16H20N5O+ MolecularWeight: 298.3629

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CNC(=O)C2=NC=CN=C2)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CNC(=O)C2=NC=CN=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H19N5O/c22-16(15-12-17-6-7-18-15)19-13-20-8-10-21(11-9-20)14-4-2-1-3-5-14/h1-7,12H,8-11,13H2,(H,19,22)/p+1