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

Systemtic Name: 2-[2-[(2-oxidanylidene-4-phenyl-1,3-dihydro-1,5-benzodiazepin-3-yl)oxy]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[(2-oxo-4-phenyl-1,3-dihydro-1,5-benzodiazepin-3-yl)oxy]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(2-oxo-4-phenyl-1,3-dihydro-1,5-benzodiazepin-3-yl)oxy]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[(2-oxo-4-phenyl-1,3-dihydro-1,5-benzodiazepin-3-yl)oxy]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(2-keto-4-phenyl-1,3-dihydro-1,5-benzodiazepin-3-yl)oxy]ethyl]isoindoline-1,3-quinone Formula: C25H19N3O4 MolecularWeight: 425.43606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3NC(=O)C2OCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3NC(=O)C2OCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H19N3O4/c29-23-22(32-15-14-28-24(30)17-10-4-5-11-18(17)25(28)31)21(16-8-2-1-3-9-16)26-19-12-6-7-13-20(19)27-23/h1-13,22H,14-15H2,(H,27,29)