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

Systemtic Name: 2-[5-cyclopentyl-2-oxidanylidene-1-(2-oxidanylideneethenyl)-3H-1,4-benzodiazepin-3-yl]isoindole-1,3-dione Openeye Name: 2-[5-cyclopentyl-2-oxo-1-(2-oxovinyl)-3H-1,4-benzodiazepin-3-yl]isoindoline-1,3-dione CAS Name: 2-[5-cyclopentyl-2-oxo-1-(2-oxoethenyl)-3H-1,4-benzodiazepin-3-yl]isoindole-1,3-dione IUPAC Name: 2-[5-cyclopentyl-2-oxo-1-(2-oxoethenyl)-3H-1,4-benzodiazepin-3-yl]isoindole-1,3-dione Traditional Name: 2-[5-cyclopentyl-2-keto-1-(2-ketovinyl)-3H-1,4-benzodiazepin-3-yl]isoindoline-1,3-quinone Formula: C24H19N3O4 MolecularWeight: 413.42536

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=NC(C(=O)N(C3=CC=CC=C32)C=C=O)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CCC(C1)C2=NC(C(=O)N(C3=CC=CC=C32)C=C=O)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C24H19N3O4/c28-14-13-26-19-12-6-5-11-18(19)20(15-7-1-2-8-15)25-21(24(26)31)27-22(29)16-9-3-4-10-17(16)23(27)30/h3-6,9-13,15,21H,1-2,7-8H2