(3-phenoxyphenyl)methyl 1-cyano-3-methanoyl-2,2-dimethyl-cyclopropane-1-carboxylate

Systemtic Name: (3-phenoxyphenyl)methyl 1-cyano-3-methanoyl-2,2-dimethyl-cyclopropane-1-carboxylate Openeye Name: (3-phenoxyphenyl)methyl 1-cyano-3-formyl-2,2-dimethyl-cyclopropanecarboxylate CAS Name: 1-cyano-3-formyl-2,2-dimethyl-1-cyclopropanecarboxylic acid (3-phenoxyphenyl)methyl ester IUPAC Name: (3-phenoxyphenyl)methyl 1-cyano-3-formyl-2,2-dimethylcyclopropane-1-carboxylate Traditional Name: 1-cyano-3-formyl-2,2-dimethyl-cyclopropanecarboxylic acid (3-phenoxybenzyl) ester Formula: C21H19NO4 MolecularWeight: 349.37986

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C1(C#N)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3)C=O)C

Isomeric SMILES

CC1(C(C1(C#N)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3)C=O)C

InChI

InChI=1S/C21H19NO4/c1-20(2)18(12-23)21(20,14-22)19(24)25-13-15-7-6-10-17(11-15)26-16-8-4-3-5-9-16/h3-12,18H,13H2,1-2H3