1-[cyano-(3-phenoxyphenyl)methyl]-3-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylic acid

Systemtic Name: 1-[cyano-(3-phenoxyphenyl)methyl]-3-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylic acid Openeye Name: 1-[cyano-(3-phenoxyphenyl)methyl]-3-[(E)-3-methoxy-3-oxo-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylic acid CAS Name: 1-[cyano-(3-phenoxyphenyl)methyl]-3-[(E)-3-methoxy-3-oxoprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid IUPAC Name: 1-[cyano-(3-phenoxyphenyl)methyl]-3-[(E)-3-methoxy-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylic acid Traditional Name: 1-[cyano-(3-phenoxyphenyl)methyl]-3-[(E)-3-keto-3-methoxy-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylic acid Formula: C24H23NO5 MolecularWeight: 405.44312

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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=CC(=O)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C24H23NO5/c1-23(2)20(12-13-21(26)29-3)24(23,22(27)28)19(15-25)16-8-7-11-18(14-16)30-17-9-5-4-6-10-17/h4-14,19-20H,1-3H3,(H,27,28)/b13-12+