2-[[2-oxidanylidene-1-(phenylmethyl)-3H-1,5-benzodiazepin-4-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[2-oxidanylidene-1-(phenylmethyl)-3H-1,5-benzodiazepin-4-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[(1-benzyl-2-oxo-3H-1,5-benzodiazepin-4-yl)methyl]isoindoline-1,3-dione CAS Name: 2-[[2-oxo-1-(phenylmethyl)-3H-1,5-benzodiazepin-4-yl]methyl]isoindole-1,3-dione IUPAC Name: 2-[(1-benzyl-2-oxo-3H-1,5-benzodiazepin-4-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[(1-benzyl-2-keto-3H-1,5-benzodiazepin-4-yl)methyl]isoindoline-1,3-quinone Formula: C25H19N3O3 MolecularWeight: 409.43666

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=CC=CC=C2N(C1=O)CC3=CC=CC=C3)CN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1C(=NC2=CC=CC=C2N(C1=O)CC3=CC=CC=C3)CN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H19N3O3/c29-23-14-18(16-28-24(30)19-10-4-5-11-20(19)25(28)31)26-21-12-6-7-13-22(21)27(23)15-17-8-2-1-3-9-17/h1-13H,14-16H2