9-(3,4,5-triphenylpyrazol-1-yl)nonanenitrile

Systemtic Name: 9-(3,4,5-triphenylpyrazol-1-yl)nonanenitrile Openeye Name: 9-(3,4,5-triphenylpyrazol-1-yl)nonanenitrile CAS Name: 9-(3,4,5-triphenyl-1-pyrazolyl)nonanenitrile IUPAC Name: 9-(3,4,5-triphenylpyrazol-1-yl)nonanenitrile Traditional Name: 9-(3,4,5-triphenylpyrazol-1-yl)pelargononitrile Formula: C30H31N3 MolecularWeight: 433.58724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(N=C2C3=CC=CC=C3)CCCCCCCCC#N)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(N=C2C3=CC=CC=C3)CCCCCCCCC#N)C4=CC=CC=C4

InChI

InChI=1S/C30H31N3/c31-23-15-4-2-1-3-5-16-24-33-30(27-21-13-8-14-22-27)28(25-17-9-6-10-18-25)29(32-33)26-19-11-7-12-20-26/h6-14,17-22H,1-5,15-16,24H2