2-[5-(2-fluorophenyl)-2-oxidanylidene-9-propan-2-yl-1,3-dihydro-1,4-benzodiazepin-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[5-(2-fluorophenyl)-2-oxidanylidene-9-propan-2-yl-1,3-dihydro-1,4-benzodiazepin-3-yl]isoindole-1,3-dione Openeye Name: 2-[5-(2-fluorophenyl)-9-isopropyl-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]isoindoline-1,3-dione CAS Name: 2-[5-(2-fluorophenyl)-2-oxo-9-propan-2-yl-1,3-dihydro-1,4-benzodiazepin-3-yl]isoindole-1,3-dione IUPAC Name: 2-[5-(2-fluorophenyl)-2-oxo-9-propan-2-yl-1,3-dihydro-1,4-benzodiazepin-3-yl]isoindole-1,3-dione Traditional Name: 2-[5-(2-fluorophenyl)-9-isopropyl-2-keto-1,3-dihydro-1,4-benzodiazepin-3-yl]isoindoline-1,3-quinone Formula: C26H20FN3O3 MolecularWeight: 441.453703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC2=C1NC(=O)C(N=C2C3=CC=CC=C3F)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC(C)C1=CC=CC2=C1NC(=O)C(N=C2C3=CC=CC=C3F)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C26H20FN3O3/c1-14(2)15-11-7-12-19-21(15)29-24(31)23(28-22(19)18-10-5-6-13-20(18)27)30-25(32)16-8-3-4-9-17(16)26(30)33/h3-14,23H,1-2H3,(H,29,31)