2-[3-[(6-chloranyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino]-2-oxidanylidene-propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[(6-chloranyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino]-2-oxidanylidene-propyl]isoindole-1,3-dione Openeye Name: 2-[3-[(6-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino]-2-oxo-propyl]isoindoline-1,3-dione CAS Name: 2-[3-[(6-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino]-2-oxopropyl]isoindole-1,3-dione IUPAC Name: 2-[3-[(6-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino]-2-oxopropyl]isoindole-1,3-dione Traditional Name: 2-[3-[(6-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino]-2-keto-propyl]isoindoline-1,3-quinone Formula: C26H19ClN4O3 MolecularWeight: 470.90706

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(C(=CC=C2)Cl)C(=N1)C3=CC=CC=C3)NCC(=O)CN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1C(=NC2=C(C(=CC=C2)Cl)C(=N1)C3=CC=CC=C3)NCC(=O)CN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C26H19ClN4O3/c27-20-11-6-12-21-23(20)24(16-7-2-1-3-8-16)29-14-22(30-21)28-13-17(32)15-31-25(33)18-9-4-5-10-19(18)26(31)34/h1-12H,13-15H2,(H,28,30)