3-[2-[4-(2-azanyl-4-fluoranyl-3-iodanyl-phenyl)carbonylpiperidin-1-yl]ethyl]-1H-quinazoline-2,4-dione

Systemtic Name: 3-[2-[4-(2-azanyl-4-fluoranyl-3-iodanyl-phenyl)carbonylpiperidin-1-yl]ethyl]-1H-quinazoline-2,4-dione Openeye Name: 3-[2-[4-(2-amino-4-fluoro-3-iodo-benzoyl)-1-piperidyl]ethyl]-1H-quinazoline-2,4-dione CAS Name: 3-[2-[4-[(2-amino-4-fluoro-3-iodophenyl)-oxomethyl]-1-piperidinyl]ethyl]-1H-quinazoline-2,4-dione IUPAC Name: 3-[2-[4-(2-amino-4-fluoro-3-iodobenzoyl)piperidin-1-yl]ethyl]-1H-quinazoline-2,4-dione Traditional Name: 3-[2-[4-(2-amino-4-fluoro-3-iodo-benzoyl)piperidino]ethyl]-1H-quinazoline-2,4-quinone Formula: C22H22FIN4O3 MolecularWeight: 536.337953

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=C(C(=C(C=C2)F)I)N)CCN3C(=O)C4=CC=CC=C4NC3=O

Isomeric SMILES

C1CN(CCC1C(=O)C2=C(C(=C(C=C2)F)I)N)CCN3C(=O)C4=CC=CC=C4NC3=O

InChI

InChI=1S/C22H22FIN4O3/c23-16-6-5-15(19(25)18(16)24)20(29)13-7-9-27(10-8-13)11-12-28-21(30)14-3-1-2-4-17(14)26-22(28)31/h1-6,13H,7-12,25H2,(H,26,31)