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

Systemtic Name: 2-ethyl-4-(4-ethylpiperazin-4-ium-1-yl)carbonyl-phthalazin-1-one Openeye Name: 2-ethyl-4-(4-ethylpiperazin-4-ium-1-carbonyl)phthalazin-1-one CAS Name: 2-ethyl-4-[(4-ethyl-1-piperazin-4-iumyl)-oxomethyl]-1-phthalazinone IUPAC Name: 2-ethyl-4-(4-ethylpiperazin-4-ium-1-carbonyl)phthalazin-1-one Traditional Name: 2-ethyl-4-(4-ethylpiperazin-4-ium-1-carbonyl)phthalazin-1-one Formula: C17H23N4O2+ MolecularWeight: 315.39012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4O2/c1-3-19-9-11-20(12-10-19)17(23)15-13-7-5-6-8-14(13)16(22)21(4-2)18-15/h5-8H,3-4,9-12H2,1-2H3/p+1