4-ethanoyl-4-phenyl-heptanedinitrile

Systemtic Name: 4-ethanoyl-4-phenyl-heptanedinitrile Openeye Name: 4-acetyl-4-phenyl-heptanedinitrile CAS Name: 4-acetyl-4-phenylheptanedinitrile IUPAC Name: 4-acetyl-4-phenylheptanedinitrile Traditional Name: 4-acetyl-4-phenyl-pimelonitrile Formula: C15H16N2O MolecularWeight: 240.30034

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCC#N)(CCC#N)C1=CC=CC=C1

Isomeric SMILES

CC(=O)C(CCC#N)(CCC#N)C1=CC=CC=C1

InChI

InChI=1S/C15H16N2O/c1-13(18)15(9-5-11-16,10-6-12-17)14-7-3-2-4-8-14/h2-4,7-8H,5-6,9-10H2,1H3