6-bromanyl-3-ethanoyl-2-[[4-[(E)-methoxyiminomethyl]phenyl]methyl]-4-phenyl-isoquinolin-1-one

Systemtic Name: 6-bromanyl-3-ethanoyl-2-[[4-[(E)-methoxyiminomethyl]phenyl]methyl]-4-phenyl-isoquinolin-1-one Openeye Name: 3-acetyl-6-bromo-2-[[4-[(E)-methoxyiminomethyl]phenyl]methyl]-4-phenyl-isoquinolin-1-one CAS Name: 3-acetyl-6-bromo-2-[[4-[(E)-methoxyiminomethyl]phenyl]methyl]-4-phenyl-1-isoquinolinone IUPAC Name: 3-acetyl-6-bromo-2-[[4-[(E)-methoxyiminomethyl]phenyl]methyl]-4-phenylisoquinolin-1-one Traditional Name: 3-acetyl-6-bromo-2-[4-[(E)-methyloximinomethyl]benzyl]-4-phenyl-isocarbostyril Formula: C26H21BrN2O3 MolecularWeight: 489.36054

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C2=C(C=CC(=C2)Br)C(=O)N1CC3=CC=C(C=C3)C=NOC)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=C(C2=C(C=CC(=C2)Br)C(=O)N1CC3=CC=C(C=C3)/C=N/OC)C4=CC=CC=C4

InChI

InChI=1S/C26H21BrN2O3/c1-17(30)25-24(20-6-4-3-5-7-20)23-14-21(27)12-13-22(23)26(31)29(25)16-19-10-8-18(9-11-19)15-28-32-2/h3-15H,16H2,1-2H3/b28-15+