2-(6-bromanylhexanoyl)-1H-isoquinoline-1-carbonitrile

Systemtic Name: 2-(6-bromanylhexanoyl)-1H-isoquinoline-1-carbonitrile Openeye Name: 2-(6-bromohexanoyl)-1H-isoquinoline-1-carbonitrile CAS Name: 2-(6-bromo-1-oxohexyl)-1H-isoquinoline-1-carbonitrile IUPAC Name: 2-(6-bromohexanoyl)-1H-isoquinoline-1-carbonitrile Traditional Name: 2-(6-bromohexanoyl)-1H-isoquinoline-1-carbonitrile Formula: C16H17BrN2O MolecularWeight: 333.22298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(N(C=CC2=C1)C(=O)CCCCCBr)C#N

Isomeric SMILES

C1=CC=C2C(N(C=CC2=C1)C(=O)CCCCCBr)C#N

InChI

InChI=1S/C16H17BrN2O/c17-10-5-1-2-8-16(20)19-11-9-13-6-3-4-7-14(13)15(19)12-18/h3-4,6-7,9,11,15H,1-2,5,8,10H2