N-(2-ethylphenyl)-2-[4-(5-methylpyrazin-2-yl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[4-(5-methylpyrazin-2-yl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[4-(5-methylpyrazine-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-ethylphenyl)-2-[4-[(5-methyl-2-pyrazinyl)-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[4-(5-methylpyrazine-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-ethylphenyl)-2-[4-(5-methylpyrazinoyl)piperazin-1-ium-1-yl]acetamide Formula: C20H26N5O2+ MolecularWeight: 368.45274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CN=C(C=N3)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CN=C(C=N3)C

InChI

InChI=1S/C20H25N5O2/c1-3-16-6-4-5-7-17(16)23-19(26)14-24-8-10-25(11-9-24)20(27)18-13-21-15(2)12-22-18/h4-7,12-13H,3,8-11,14H2,1-2H3,(H,23,26)/p+1