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

Systemtic Name: 5-bromanyl-6-methoxy-2-methyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carbonitrile Openeye Name: 5-bromo-6-methoxy-2-methyl-1-oxo-4-phenyl-isoquinoline-3-carbonitrile CAS Name: 5-bromo-6-methoxy-2-methyl-1-oxo-4-phenyl-3-isoquinolinecarbonitrile IUPAC Name: 5-bromo-6-methoxy-2-methyl-1-oxo-4-phenylisoquinoline-3-carbonitrile Traditional Name: 5-bromo-1-keto-6-methoxy-2-methyl-4-phenyl-isoquinoline-3-carbonitrile Formula: C18H13BrN2O2 MolecularWeight: 369.21202

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2Br)OC)C3=CC=CC=C3)C#N

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2Br)OC)C3=CC=CC=C3)C#N

InChI

InChI=1S/C18H13BrN2O2/c1-21-13(10-20)15(11-6-4-3-5-7-11)16-12(18(21)22)8-9-14(23-2)17(16)19/h3-9H,1-2H3