2-(2-methylpropanoyl)-1H-isoquinoline-1-carbonitrile

Systemtic Name: 2-(2-methylpropanoyl)-1H-isoquinoline-1-carbonitrile Openeye Name: 2-(2-methylpropanoyl)-1H-isoquinoline-1-carbonitrile CAS Name: 2-(2-methyl-1-oxopropyl)-1H-isoquinoline-1-carbonitrile IUPAC Name: 2-(2-methylpropanoyl)-1H-isoquinoline-1-carbonitrile Traditional Name: 2-isobutyryl-1H-isoquinoline-1-carbonitrile Formula: C14H14N2O MolecularWeight: 226.27376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1C=CC2=CC=CC=C2C1C#N

Isomeric SMILES

CC(C)C(=O)N1C=CC2=CC=CC=C2C1C#N

InChI

InChI=1S/C14H14N2O/c1-10(2)14(17)16-8-7-11-5-3-4-6-12(11)13(16)9-15/h3-8,10,13H,1-2H3