(7S)-7-(2-fluorophenyl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-7,8-dihydro-6H-quinazolin-5-one

Systemtic Name: (7S)-7-(2-fluorophenyl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-7,8-dihydro-6H-quinazolin-5-one Openeye Name: (7S)-7-(2-fluorophenyl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-7,8-dihydro-6H-quinazolin-5-one CAS Name: (7S)-7-(2-fluorophenyl)-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-7,8-dihydro-6H-quinazolin-5-one IUPAC Name: (7S)-7-(2-fluorophenyl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-7,8-dihydro-6H-quinazolin-5-one Traditional Name: (7S)-7-(2-fluorophenyl)-2-(4-pyridin-1-ium-2-ylpiperazino)-7,8-dihydro-6H-quinazolin-5-one Formula: C23H23FN5O+ MolecularWeight: 404.460023

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C3=NC=C4C(=N3)CC(CC4=O)C5=CC=CC=C5F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C3=NC=C4C(=N3)C[C@@H](CC4=O)C5=CC=CC=C5F

InChI

InChI=1S/C23H22FN5O/c24-19-6-2-1-5-17(19)16-13-20-18(21(30)14-16)15-26-23(27-20)29-11-9-28(10-12-29)22-7-3-4-8-25-22/h1-8,15-16H,9-14H2/p+1/t16-/m0/s1