3-azanyl-2-[2,6-bis(bromanyl)-4-methyl-phenyl]isoquinolin-1-one

Systemtic Name: 3-azanyl-2-[2,6-bis(bromanyl)-4-methyl-phenyl]isoquinolin-1-one Openeye Name: 3-amino-2-(2,6-dibromo-4-methyl-phenyl)isoquinolin-1-one CAS Name: 3-amino-2-(2,6-dibromo-4-methylphenyl)-1-isoquinolinone IUPAC Name: 3-amino-2-(2,6-dibromo-4-methylphenyl)isoquinolin-1-one Traditional Name: 3-amino-2-(2,6-dibromo-4-methyl-phenyl)isocarbostyril Formula: C16H12Br2N2O MolecularWeight: 408.08728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)N2C(=CC3=CC=CC=C3C2=O)N)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)N2C(=CC3=CC=CC=C3C2=O)N)Br

InChI

InChI=1S/C16H12Br2N2O/c1-9-6-12(17)15(13(18)7-9)20-14(19)8-10-4-2-3-5-11(10)16(20)21/h2-8H,19H2,1H3