N-[3-[2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoylamino]phenyl]pyridine-3-carboxamide

Systemtic Name: N-[3-[2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoylamino]phenyl]pyridine-3-carboxamide Openeye Name: N-[3-[[2-(5-bromo-1,3-dioxo-isoindolin-2-yl)acetyl]amino]phenyl]pyridine-3-carboxamide CAS Name: N-[3-[[2-(5-bromo-1,3-dioxo-2-isoindolyl)-1-oxoethyl]amino]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[3-[[2-(5-bromo-1,3-dioxoisoindol-2-yl)acetyl]amino]phenyl]pyridine-3-carboxamide Traditional Name: N-[3-[[2-(5-bromo-1,3-diketo-isoindolin-2-yl)acetyl]amino]phenyl]nicotinamide Formula: C22H15BrN4O4 MolecularWeight: 479.2829

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)Br)NC(=O)C4=CN=CC=C4

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)Br)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H15BrN4O4/c23-14-6-7-17-18(9-14)22(31)27(21(17)30)12-19(28)25-15-4-1-5-16(10-15)26-20(29)13-3-2-8-24-11-13/h1-11H,12H2,(H,25,28)(H,26,29)