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

Systemtic Name: 2-[9-ethyl-5-(2-fluorophenyl)-2-oxidanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl]isoindole-1,3-dione Openeye Name: 2-[9-ethyl-5-(2-fluorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]isoindoline-1,3-dione CAS Name: 2-[9-ethyl-5-(2-fluorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]isoindole-1,3-dione IUPAC Name: 2-[9-ethyl-5-(2-fluorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]isoindole-1,3-dione Traditional Name: 2-[9-ethyl-5-(2-fluorophenyl)-2-keto-1,3-dihydro-1,4-benzodiazepin-3-yl]isoindoline-1,3-quinone Formula: C25H18FN3O3 MolecularWeight: 427.427123

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC(=O)C(N=C2C3=CC=CC=C3F)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CCC1=CC=CC2=C1NC(=O)C(N=C2C3=CC=CC=C3F)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H18FN3O3/c1-2-14-8-7-12-18-20(14)28-23(30)22(27-21(18)17-11-5-6-13-19(17)26)29-24(31)15-9-3-4-10-16(15)25(29)32/h3-13,22H,2H2,1H3,(H,28,30)