[2-[[(3-azanylpyrazin-4-ium-2-yl)carbonylamino]methyl]phenyl]methyl-diethyl-azanium

Systemtic Name: [2-[[(3-azanylpyrazin-4-ium-2-yl)carbonylamino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [2-[[(3-aminopyrazin-4-ium-2-carbonyl)amino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [2-[[[(3-amino-2-pyrazin-4-iumyl)-oxomethyl]amino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [2-[[(3-aminopyrazin-4-ium-2-carbonyl)amino]methyl]phenyl]methyl-diethylazanium Traditional Name: [2-[[(3-aminopyrazin-4-ium-2-carbonyl)amino]methyl]benzyl]-diethyl-ammonium Formula: C17H25N5O+2 MolecularWeight: 315.4133

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=CC=C1CNC(=O)C2=NC=C[NH+]=C2N

Isomeric SMILES

CC[NH+](CC)CC1=CC=CC=C1CNC(=O)C2=NC=C[NH+]=C2N

InChI

InChI=1S/C17H23N5O/c1-3-22(4-2)12-14-8-6-5-7-13(14)11-21-17(23)15-16(18)20-10-9-19-15/h5-10H,3-4,11-12H2,1-2H3,(H2,18,20)(H,21,23)/p+2