(Z)-3-[4-(2-tert-butyl-5-methyl-phenoxy)phenyl]-2-cyano-prop-2-enoate

Systemtic Name: (Z)-3-[4-(2-tert-butyl-5-methyl-phenoxy)phenyl]-2-cyano-prop-2-enoate Openeye Name: (Z)-3-[4-(2-tert-butyl-5-methyl-phenoxy)phenyl]-2-cyano-prop-2-enoate CAS Name: (Z)-3-[4-(2-tert-butyl-5-methylphenoxy)phenyl]-2-cyano-2-propenoate IUPAC Name: (Z)-3-[4-(2-tert-butyl-5-methylphenoxy)phenyl]-2-cyanoprop-2-enoate Traditional Name: (Z)-3-[4-(2-tert-butyl-5-methyl-phenoxy)phenyl]-2-cyano-acrylate Formula: C21H20NO3- MolecularWeight: 334.3884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)(C)C)OC2=CC=C(C=C2)C=C(C#N)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)(C)C)OC2=CC=C(C=C2)/C=C(/C#N)\C(=O)[O-]

InChI

InChI=1S/C21H21NO3/c1-14-5-10-18(21(2,3)4)19(11-14)25-17-8-6-15(7-9-17)12-16(13-22)20(23)24/h5-12H,1-4H3,(H,23,24)/p-1/b16-12-