4-bromanyl-N-[(E)-[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]benzamide

Systemtic Name: 4-bromanyl-N-[(E)-[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]benzamide Openeye Name: 4-bromo-N-[(E)-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]benzamide CAS Name: 4-bromo-N-[(E)-[2-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]benzamide IUPAC Name: 4-bromo-N-[(E)-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]benzamide Traditional Name: 4-bromo-N-[(E)-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]benzamide Formula: C26H24BrN3O3 MolecularWeight: 506.39106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=C(C=C3)Br)CCC2)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=C(C=C3)Br)/CCC2)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C26H24BrN3O3/c1-16-23-21(28-29-25(31)18-9-11-20(27)12-10-18)7-4-8-22(23)33-24(16)26(32)30-14-13-17-5-2-3-6-19(17)15-30/h2-3,5-6,9-12H,4,7-8,13-15H2,1H3,(H,29,31)/b28-21+