2-[5-(2-fluorophenyl)-2-oxidanylidene-1-(quinolin-2-ylmethyl)-3H-1,4-benzodiazepin-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[5-(2-fluorophenyl)-2-oxidanylidene-1-(quinolin-2-ylmethyl)-3H-1,4-benzodiazepin-3-yl]isoindole-1,3-dione Openeye Name: 2-[5-(2-fluorophenyl)-2-oxo-1-(2-quinolylmethyl)-3H-1,4-benzodiazepin-3-yl]isoindoline-1,3-dione CAS Name: 2-[5-(2-fluorophenyl)-2-oxo-1-(2-quinolinylmethyl)-3H-1,4-benzodiazepin-3-yl]isoindole-1,3-dione IUPAC Name: 2-[5-(2-fluorophenyl)-2-oxo-1-(quinolin-2-ylmethyl)-3H-1,4-benzodiazepin-3-yl]isoindole-1,3-dione Traditional Name: 2-[5-(2-fluorophenyl)-2-keto-1-(2-quinolylmethyl)-3H-1,4-benzodiazepin-3-yl]isoindoline-1,3-quinone Formula: C33H21FN4O3 MolecularWeight: 540.543243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)CN3C4=CC=CC=C4C(=NC(C3=O)N5C(=O)C6=CC=CC=C6C5=O)C7=CC=CC=C7F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)CN3C4=CC=CC=C4C(=NC(C3=O)N5C(=O)C6=CC=CC=C6C5=O)C7=CC=CC=C7F

InChI

InChI=1S/C33H21FN4O3/c34-26-14-6-4-12-24(26)29-25-13-5-8-16-28(25)37(19-21-18-17-20-9-1-7-15-27(20)35-21)33(41)30(36-29)38-31(39)22-10-2-3-11-23(22)32(38)40/h1-18,30H,19H2