4-[bis(oxidanyl)methyl]-1-(1-cyclohexyl-3-ethyl-indazol-6-yl)cyclohexane-1-carbonitrile

Systemtic Name: 4-[bis(oxidanyl)methyl]-1-(1-cyclohexyl-3-ethyl-indazol-6-yl)cyclohexane-1-carbonitrile Openeye Name: 1-(1-cyclohexyl-3-ethyl-indazol-6-yl)-4-(dihydroxymethyl)cyclohexanecarbonitrile CAS Name: 1-(1-cyclohexyl-3-ethyl-6-indazolyl)-4-(dihydroxymethyl)-1-cyclohexanecarbonitrile IUPAC Name: 1-(1-cyclohexyl-3-ethylindazol-6-yl)-4-(dihydroxymethyl)cyclohexane-1-carbonitrile Traditional Name: 1-(1-cyclohexyl-3-ethyl-indazol-6-yl)-4-(dihydroxymethyl)cyclohexanecarbonitrile Formula: C23H31N3O2 MolecularWeight: 381.51114

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C2=C1C=CC(=C2)C3(CCC(CC3)C(O)O)C#N)C4CCCCC4

Isomeric SMILES

CCC1=NN(C2=C1C=CC(=C2)C3(CCC(CC3)C(O)O)C#N)C4CCCCC4

InChI

InChI=1S/C23H31N3O2/c1-2-20-19-9-8-17(23(15-24)12-10-16(11-13-23)22(27)28)14-21(19)26(25-20)18-6-4-3-5-7-18/h8-9,14,16,18,22,27-28H,2-7,10-13H2,1H3