8-[(2R)-2,5,7,8-tetramethyl-6-oxidanyl-3,4-dihydrochromen-2-yl]octanenitrile

Systemtic Name: 8-[(2R)-2,5,7,8-tetramethyl-6-oxidanyl-3,4-dihydrochromen-2-yl]octanenitrile Openeye Name: 8-[(2R)-6-hydroxy-2,5,7,8-tetramethyl-chroman-2-yl]octanenitrile CAS Name: 8-[(2R)-6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-2-yl]octanenitrile IUPAC Name: 8-[(2R)-6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl]octanenitrile Traditional Name: 8-[(2R)-6-hydroxy-2,5,7,8-tetramethyl-chroman-2-yl]caprylonitrile Formula: C21H31NO2 MolecularWeight: 329.47634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2CCC(OC2=C1C)(C)CCCCCCCC#N)C)O

Isomeric SMILES

CC1=C(C(=C2CC[C@@](OC2=C1C)(C)CCCCCCCC#N)C)O

InChI

InChI=1S/C21H31NO2/c1-15-16(2)20-18(17(3)19(15)23)11-13-21(4,24-20)12-9-7-5-6-8-10-14-22/h23H,5-13H2,1-4H3/t21-/m1/s1