N-[2-[6-bromanyl-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]ethyl]-2-nitro-N-phenyl-benzamide

Systemtic Name: N-[2-[6-bromanyl-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]ethyl]-2-nitro-N-phenyl-benzamide Openeye Name: N-[2-(6-bromo-1,3-dioxo-benzo[de]isoquinolin-2-yl)ethyl]-2-nitro-N-phenyl-benzamide CAS Name: N-[2-(6-bromo-1,3-dioxo-2-benzo[de]isoquinolinyl)ethyl]-2-nitro-N-phenylbenzamide IUPAC Name: N-[2-(6-bromo-1,3-dioxobenzo[de]isoquinolin-2-yl)ethyl]-2-nitro-N-phenylbenzamide Traditional Name: N-[2-(6-bromo-1,3-diketo-benzo[de]isoquinolin-2-yl)ethyl]-2-nitro-N-phenyl-benzamide Formula: C27H18BrN3O5 MolecularWeight: 544.35292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCN2C(=O)C3=C4C(=C(C=C3)Br)C=CC=C4C2=O)C(=O)C5=CC=CC=C5[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N(CCN2C(=O)C3=C4C(=C(C=C3)Br)C=CC=C4C2=O)C(=O)C5=CC=CC=C5[N+](=O)[O-]

InChI

InChI=1S/C27H18BrN3O5/c28-22-14-13-21-24-18(22)10-6-11-20(24)26(33)30(27(21)34)16-15-29(17-7-2-1-3-8-17)25(32)19-9-4-5-12-23(19)31(35)36/h1-14H,15-16H2