(1R,3R)-2,2-dimethyl-3-(3-oxidanyl-3-oxidanylidene-prop-1-ynyl)-1-[1-(3-phenoxyphenyl)ethyl]cyclopropane-1-carboxylic acid

Systemtic Name: (1R,3R)-2,2-dimethyl-3-(3-oxidanyl-3-oxidanylidene-prop-1-ynyl)-1-[1-(3-phenoxyphenyl)ethyl]cyclopropane-1-carboxylic acid Openeye Name: (1R,3R)-3-(3-hydroxy-3-oxo-prop-1-ynyl)-2,2-dimethyl-1-[1-(3-phenoxyphenyl)ethyl]cyclopropanecarboxylic acid CAS Name: (1R,3R)-3-(3-hydroxy-3-oxoprop-1-ynyl)-2,2-dimethyl-1-[1-(3-phenoxyphenyl)ethyl]-1-cyclopropanecarboxylic acid IUPAC Name: (1R,3R)-3-(3-hydroxy-3-oxoprop-1-ynyl)-2,2-dimethyl-1-[1-(3-phenoxyphenyl)ethyl]cyclopropane-1-carboxylic acid Traditional Name: (1R,3R)-3-(3-hydroxy-3-keto-prop-1-ynyl)-2,2-dimethyl-1-[1-(3-phenoxyphenyl)ethyl]cyclopropanecarboxylic acid Formula: C23H22O5 MolecularWeight: 378.41778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C3(C(C3(C)C)C#CC(=O)O)C(=O)O

Isomeric SMILES

CC(C1=CC(=CC=C1)OC2=CC=CC=C2)[C@]3([C@@H](C3(C)C)C#CC(=O)O)C(=O)O

InChI

InChI=1S/C23H22O5/c1-15(23(21(26)27)19(22(23,2)3)12-13-20(24)25)16-8-7-11-18(14-16)28-17-9-5-4-6-10-17/h4-11,14-15,19H,1-3H3,(H,24,25)(H,26,27)/t15?,19-,23+/m1/s1