4-[3-[1,4-bis(oxidanyl)cyclohexyl]-5-(4-methylphenyl)pyrazol-1-yl]benzenecarbonitrile

Systemtic Name: 4-[3-[1,4-bis(oxidanyl)cyclohexyl]-5-(4-methylphenyl)pyrazol-1-yl]benzenecarbonitrile Openeye Name: 4-[3-(1,4-dihydroxycyclohexyl)-5-(p-tolyl)pyrazol-1-yl]benzonitrile CAS Name: 4-[3-(1,4-dihydroxycyclohexyl)-5-(4-methylphenyl)-1-pyrazolyl]benzonitrile IUPAC Name: 4-[3-(1,4-dihydroxycyclohexyl)-5-(4-methylphenyl)pyrazol-1-yl]benzonitrile Traditional Name: 4-[3-(1,4-dihydroxycyclohexyl)-5-(p-tolyl)pyrazol-1-yl]benzonitrile Formula: C23H23N3O2 MolecularWeight: 373.44762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)C#N)C4(CCC(CC4)O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)C#N)C4(CCC(CC4)O)O

InChI

InChI=1S/C23H23N3O2/c1-16-2-6-18(7-3-16)21-14-22(23(28)12-10-20(27)11-13-23)25-26(21)19-8-4-17(15-24)5-9-19/h2-9,14,20,27-28H,10-13H2,1H3