1-[cyano-(3-phenoxyphenyl)methyl]-2,2,3,3-tetramethyl-cyclopropane-1-carboxylate

Systemtic Name: 1-[cyano-(3-phenoxyphenyl)methyl]-2,2,3,3-tetramethyl-cyclopropane-1-carboxylate Openeye Name: 1-[cyano-(3-phenoxyphenyl)methyl]-2,2,3,3-tetramethyl-cyclopropanecarboxylate CAS Name: 1-[cyano-(3-phenoxyphenyl)methyl]-2,2,3,3-tetramethyl-1-cyclopropanecarboxylate IUPAC Name: 1-[cyano-(3-phenoxyphenyl)methyl]-2,2,3,3-tetramethylcyclopropane-1-carboxylate Traditional Name: 1-[cyano-(3-phenoxyphenyl)methyl]-2,2,3,3-tetramethyl-cyclopropanecarboxylate Formula: C22H22NO3- MolecularWeight: 348.41498

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C1(C(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)[O-])(C)C)C

Isomeric SMILES

CC1(C(C1(C(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)[O-])(C)C)C

InChI

InChI=1S/C22H23NO3/c1-20(2)21(3,4)22(20,19(24)25)18(14-23)15-9-8-12-17(13-15)26-16-10-6-5-7-11-16/h5-13,18H,1-4H3,(H,24,25)/p-1