4-[[(8R,9S)-8-oxidanyl-10-oxidanylidene-spiro[5.5]undecan-9-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[(8R,9S)-8-oxidanyl-10-oxidanylidene-spiro[5.5]undecan-9-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[(8R,9S)-8-hydroxy-10-oxo-spiro[5.5]undecan-9-yl]methyl]benzonitrile CAS Name: 4-[[(8R,9S)-8-hydroxy-10-oxo-9-spiro[5.5]undecanyl]methyl]benzonitrile IUPAC Name: 4-[[(8R,9S)-8-hydroxy-10-oxospiro[5.5]undecan-9-yl]methyl]benzonitrile Traditional Name: 4-[[(8R,9S)-8-hydroxy-10-keto-spiro[5.5]undecan-9-yl]methyl]benzonitrile Formula: C19H23NO2 MolecularWeight: 297.39142

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)CC(C(C(=O)C2)CC3=CC=C(C=C3)C#N)O

Isomeric SMILES

C1CCC2(CC1)C[C@H]([C@@H](C(=O)C2)CC3=CC=C(C=C3)C#N)O

InChI

InChI=1S/C19H23NO2/c20-13-15-6-4-14(5-7-15)10-16-17(21)11-19(12-18(16)22)8-2-1-3-9-19/h4-7,16-17,21H,1-3,8-12H2/t16-,17+/m0/s1