N,N-diethyl-2-[4-[2-(1-oxidanylidenephthalazin-2-yl)ethanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-diethyl-2-[4-[2-(1-oxidanylidenephthalazin-2-yl)ethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N,N-diethyl-2-[4-[2-(1-oxophthalazin-2-yl)acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: N,N-diethyl-2-[4-[1-oxo-2-(1-oxo-2-phthalazinyl)ethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N,N-diethyl-2-[4-[2-(1-oxophthalazin-2-yl)acetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N,N-diethyl-2-[4-[2-(1-ketophthalazin-2-yl)acetyl]piperazin-1-ium-1-yl]acetamide Formula: C20H28N5O3+ MolecularWeight: 386.46802

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3C=N2

Isomeric SMILES

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3C=N2

InChI

InChI=1S/C20H27N5O3/c1-3-23(4-2)18(26)14-22-9-11-24(12-10-22)19(27)15-25-20(28)17-8-6-5-7-16(17)13-21-25/h5-8,13H,3-4,9-12,14-15H2,1-2H3/p+1