(E)-3-[3-tert-butyl-5-(2-methylpentan-2-yl)-4-oxidanyl-phenyl]prop-2-enenitrile

Systemtic Name: (E)-3-[3-tert-butyl-5-(2-methylpentan-2-yl)-4-oxidanyl-phenyl]prop-2-enenitrile Openeye Name: (E)-3-[3-tert-butyl-5-(1,1-dimethylbutyl)-4-hydroxy-phenyl]prop-2-enenitrile CAS Name: (E)-3-[3-tert-butyl-4-hydroxy-5-(2-methylpentan-2-yl)phenyl]-2-propenenitrile IUPAC Name: (E)-3-[3-tert-butyl-4-hydroxy-5-(2-methylpentan-2-yl)phenyl]prop-2-enenitrile Traditional Name: (E)-3-[3-tert-butyl-5-(1,1-dimethylbutyl)-4-hydroxy-phenyl]acrylonitrile Formula: C19H27NO MolecularWeight: 285.42378

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=CC#N

Isomeric SMILES

CCCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C/C#N

InChI

InChI=1S/C19H27NO/c1-7-10-19(5,6)16-13-14(9-8-11-20)12-15(17(16)21)18(2,3)4/h8-9,12-13,21H,7,10H2,1-6H3/b9-8+