4-[(1E)-cycloocten-1-yl]-4-nitro-5-phenyl-pentanenitrile

Systemtic Name: 4-[(1E)-cycloocten-1-yl]-4-nitro-5-phenyl-pentanenitrile Openeye Name: 4-[(1E)-cycloocten-1-yl]-4-nitro-5-phenyl-pentanenitrile CAS Name: 4-[(1E)-1-cyclooctenyl]-4-nitro-5-phenylpentanenitrile IUPAC Name: 4-[(1E)-cycloocten-1-yl]-4-nitro-5-phenylpentanenitrile Traditional Name: 4-[(1E)-cycloocten-1-yl]-4-nitro-5-phenyl-valeronitrile Formula: C19H24N2O2 MolecularWeight: 312.40606

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(=CCC1)C(CCC#N)(CC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC/C(=C\CC1)/C(CCC#N)(CC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H24N2O2/c20-15-9-14-19(21(22)23,16-17-10-5-4-6-11-17)18-12-7-2-1-3-8-13-18/h4-6,10-12H,1-3,7-9,13-14,16H2/b18-12+