1-(3-tert-butyl-2-methoxy-5-methyl-phenyl)-2-isocyano-ethanol

Systemtic Name: 1-(3-tert-butyl-2-methoxy-5-methyl-phenyl)-2-isocyano-ethanol Openeye Name: 1-(3-tert-butyl-2-methoxy-5-methyl-phenyl)-2-isocyano-ethanol CAS Name: 1-(3-tert-butyl-2-methoxy-5-methylphenyl)-2-isocyanoethanol IUPAC Name: 1-(3-tert-butyl-2-methoxy-5-methylphenyl)-2-isocyanoethanol Traditional Name: 1-(3-tert-butyl-2-methoxy-5-methyl-phenyl)-2-isocyano-ethanol Formula: C15H21NO2 MolecularWeight: 247.33274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(C)(C)C)OC)C(C[N+]#[C-])O

Isomeric SMILES

CC1=CC(=C(C(=C1)C(C)(C)C)OC)C(C[N+]#[C-])O

InChI

InChI=1S/C15H21NO2/c1-10-7-11(13(17)9-16-5)14(18-6)12(8-10)15(2,3)4/h7-8,13,17H,9H2,1-4,6H3