2-ethanoyl-1,3,4,5,6,7-hexahydroisoindole-5-carbonitrile

Systemtic Name: 2-ethanoyl-1,3,4,5,6,7-hexahydroisoindole-5-carbonitrile Openeye Name: 2-acetyl-1,3,4,5,6,7-hexahydroisoindole-5-carbonitrile CAS Name: 2-acetyl-1,3,4,5,6,7-hexahydroisoindole-5-carbonitrile IUPAC Name: 2-acetyl-1,3,4,5,6,7-hexahydroisoindole-5-carbonitrile Traditional Name: 2-acetyl-1,3,4,5,6,7-hexahydroisoindole-5-carbonitrile Formula: C11H14N2O MolecularWeight: 190.24166

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC2=C(C1)CC(CC2)C#N

Isomeric SMILES

CC(=O)N1CC2=C(C1)CC(CC2)C#N

InChI

InChI=1S/C11H14N2O/c1-8(14)13-6-10-3-2-9(5-12)4-11(10)7-13/h9H,2-4,6-7H2,1H3