1-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-3-(4-fluorophenyl)quinazoline-2,4-dione

Systemtic Name: 1-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-3-(4-fluorophenyl)quinazoline-2,4-dione Openeye Name: 1-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-3-(4-fluorophenyl)quinazoline-2,4-dione CAS Name: 1-[2-(4-ethyl-1-piperazin-4-iumyl)-2-oxoethyl]-3-(4-fluorophenyl)quinazoline-2,4-dione IUPAC Name: 1-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxoethyl]-3-(4-fluorophenyl)quinazoline-2,4-dione Traditional Name: 1-[2-(4-ethylpiperazin-4-ium-1-yl)-2-keto-ethyl]-3-(4-fluorophenyl)quinazoline-2,4-quinone Formula: C22H24FN4O3+ MolecularWeight: 411.449363

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)CN2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)CN2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H23FN4O3/c1-2-24-11-13-25(14-12-24)20(28)15-26-19-6-4-3-5-18(19)21(29)27(22(26)30)17-9-7-16(23)8-10-17/h3-10H,2,11-15H2,1H3/p+1