4-(4-ethylpiperazin-4-ium-1-yl)carbonyl-2H-phthalazin-1-one

Systemtic Name: 4-(4-ethylpiperazin-4-ium-1-yl)carbonyl-2H-phthalazin-1-one Openeye Name: 4-(4-ethylpiperazin-4-ium-1-carbonyl)-2H-phthalazin-1-one CAS Name: 4-[(4-ethyl-1-piperazin-4-iumyl)-oxomethyl]-2H-phthalazin-1-one IUPAC Name: 4-(4-ethylpiperazin-4-ium-1-carbonyl)-2H-phthalazin-1-one Traditional Name: 4-(4-ethylpiperazin-4-ium-1-carbonyl)-2H-phthalazin-1-one Formula: C15H19N4O2+ MolecularWeight: 287.33696

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C15H18N4O2/c1-2-18-7-9-19(10-8-18)15(21)13-11-5-3-4-6-12(11)14(20)17-16-13/h3-6H,2,7-10H2,1H3,(H,17,20)/p+1