1-(cyano-phenoxy-phenyl-methyl)-2,2-dimethyl-3-[(E)-3-(2-methylpropoxy)-3-oxidanylidene-prop-1-enyl]cyclopropane-1-carboxylic acid

Systemtic Name: 1-(cyano-phenoxy-phenyl-methyl)-2,2-dimethyl-3-[(E)-3-(2-methylpropoxy)-3-oxidanylidene-prop-1-enyl]cyclopropane-1-carboxylic acid Openeye Name: 1-(cyano-phenoxy-phenyl-methyl)-3-[(E)-3-isobutoxy-3-oxo-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylic acid CAS Name: 1-(cyano-phenoxy-phenylmethyl)-2,2-dimethyl-3-[(E)-3-(2-methylpropoxy)-3-oxoprop-1-enyl]-1-cyclopropanecarboxylic acid IUPAC Name: 1-(cyano-phenoxy-phenylmethyl)-2,2-dimethyl-3-[(E)-3-(2-methylpropoxy)-3-oxoprop-1-enyl]cyclopropane-1-carboxylic acid Traditional Name: 1-(cyano-phenoxy-phenyl-methyl)-3-[(E)-3-isobutoxy-3-keto-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylic acid Formula: C27H29NO5 MolecularWeight: 447.52286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C=CC1C(C1(C(=O)O)C(C#N)(C2=CC=CC=C2)OC3=CC=CC=C3)(C)C

Isomeric SMILES

CC(C)COC(=O)/C=C/C1C(C1(C(=O)O)C(C#N)(C2=CC=CC=C2)OC3=CC=CC=C3)(C)C

InChI

InChI=1S/C27H29NO5/c1-19(2)17-32-23(29)16-15-22-25(3,4)27(22,24(30)31)26(18-28,20-11-7-5-8-12-20)33-21-13-9-6-10-14-21/h5-16,19,22H,17H2,1-4H3,(H,30,31)/b16-15+