7-[(4-bromophenyl)methoxy]isoquinoline-1-carbonitrile

Systemtic Name: 7-[(4-bromophenyl)methoxy]isoquinoline-1-carbonitrile Openeye Name: 7-[(4-bromophenyl)methoxy]isoquinoline-1-carbonitrile CAS Name: 7-[(4-bromophenyl)methoxy]-1-isoquinolinecarbonitrile IUPAC Name: 7-[(4-bromophenyl)methoxy]isoquinoline-1-carbonitrile Traditional Name: 7-(4-bromobenzyl)oxyisoquinoline-1-carbonitrile Formula: C17H11BrN2O MolecularWeight: 339.18604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CN=C2C#N)OCC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC2=C1C=CN=C2C#N)OCC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H11BrN2O/c18-14-4-1-12(2-5-14)11-21-15-6-3-13-7-8-20-17(10-19)16(13)9-15/h1-9H,11H2