6-bromanyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carbonitrile

Systemtic Name: 6-bromanyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carbonitrile Openeye Name: 6-bromo-2-methyl-1-oxo-4-phenyl-isoquinoline-3-carbonitrile CAS Name: 6-bromo-2-methyl-1-oxo-4-phenyl-3-isoquinolinecarbonitrile IUPAC Name: 6-bromo-2-methyl-1-oxo-4-phenylisoquinoline-3-carbonitrile Traditional Name: 6-bromo-1-keto-2-methyl-4-phenyl-isoquinoline-3-carbonitrile Formula: C17H11BrN2O MolecularWeight: 339.18604

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)Br)C3=CC=CC=C3)C#N

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)Br)C3=CC=CC=C3)C#N

InChI

InChI=1S/C17H11BrN2O/c1-20-15(10-19)16(11-5-3-2-4-6-11)14-9-12(18)7-8-13(14)17(20)21/h2-9H,1H3