4-(cyclohepten-1-yl)-4-nitro-5-phenyl-pentanenitrile

Systemtic Name: 4-(cyclohepten-1-yl)-4-nitro-5-phenyl-pentanenitrile Openeye Name: 4-(cyclohepten-1-yl)-4-nitro-5-phenyl-pentanenitrile CAS Name: 4-(1-cycloheptenyl)-4-nitro-5-phenylpentanenitrile IUPAC Name: 4-(cyclohepten-1-yl)-4-nitro-5-phenylpentanenitrile Traditional Name: 4-(cyclohepten-1-yl)-4-nitro-5-phenyl-valeronitrile Formula: C18H22N2O2 MolecularWeight: 298.37948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O2/c19-14-8-13-18(20(21)22,15-16-9-4-3-5-10-16)17-11-6-1-2-7-12-17/h3-5,9-11H,1-2,6-8,12-13,15H2