1-bromanyl-6,7-dimethoxy-isoquinoline-4-carbonitrile

Systemtic Name: 1-bromanyl-6,7-dimethoxy-isoquinoline-4-carbonitrile Openeye Name: 1-bromo-6,7-dimethoxy-isoquinoline-4-carbonitrile CAS Name: 1-bromo-6,7-dimethoxy-4-isoquinolinecarbonitrile IUPAC Name: 1-bromo-6,7-dimethoxyisoquinoline-4-carbonitrile Traditional Name: 1-bromo-6,7-dimethoxy-isoquinoline-4-carbonitrile Formula: C12H9BrN2O2 MolecularWeight: 293.11606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=CN=C2Br)C#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=CN=C2Br)C#N)OC

InChI

InChI=1S/C12H9BrN2O2/c1-16-10-3-8-7(5-14)6-15-12(13)9(8)4-11(10)17-2/h3-4,6H,1-2H3