(3E)-3-[1-(6-bromanylpyridin-3-yl)butylidene]-2-phenyl-isoindol-1-one

Systemtic Name: (3E)-3-[1-(6-bromanylpyridin-3-yl)butylidene]-2-phenyl-isoindol-1-one Openeye Name: (3E)-3-[1-(6-bromo-3-pyridyl)butylidene]-2-phenyl-isoindolin-1-one CAS Name: (3E)-3-[1-(6-bromo-3-pyridinyl)butylidene]-2-phenyl-1-isoindolone IUPAC Name: (3E)-3-[1-(6-bromopyridin-3-yl)butylidene]-2-phenylisoindol-1-one Traditional Name: (3E)-3-[1-(6-bromo-3-pyridyl)butylidene]-2-phenyl-isoindolin-1-one Formula: C23H19BrN2O MolecularWeight: 419.31376

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C1C2=CC=CC=C2C(=O)N1C3=CC=CC=C3)C4=CN=C(C=C4)Br

Isomeric SMILES

CCC/C(=C\1/C2=CC=CC=C2C(=O)N1C3=CC=CC=C3)/C4=CN=C(C=C4)Br

InChI

InChI=1S/C23H19BrN2O/c1-2-8-18(16-13-14-21(24)25-15-16)22-19-11-6-7-12-20(19)23(27)26(22)17-9-4-3-5-10-17/h3-7,9-15H,2,8H2,1H3/b22-18+