6-[2-[3-fluoranyl-4-(2-methoxy-2-oxidanylidene-ethyl)phenyl]ethynyl]-4,4-dimethyl-3H-naphthalene-1-carboxylic acid

Systemtic Name: 6-[2-[3-fluoranyl-4-(2-methoxy-2-oxidanylidene-ethyl)phenyl]ethynyl]-4,4-dimethyl-3H-naphthalene-1-carboxylic acid Openeye Name: 6-[2-[3-fluoro-4-(2-methoxy-2-oxo-ethyl)phenyl]ethynyl]-4,4-dimethyl-3H-naphthalene-1-carboxylic acid CAS Name: 6-[2-[3-fluoro-4-(2-methoxy-2-oxoethyl)phenyl]ethynyl]-4,4-dimethyl-3H-naphthalene-1-carboxylic acid IUPAC Name: 6-[2-[3-fluoro-4-(2-methoxy-2-oxoethyl)phenyl]ethynyl]-4,4-dimethyl-3H-naphthalene-1-carboxylic acid Traditional Name: 6-[2-[3-fluoro-4-(2-keto-2-methoxy-ethyl)phenyl]ethynyl]-4,4-dimethyl-3H-naphthalene-1-carboxylic acid Formula: C24H21FO4 MolecularWeight: 392.419543

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC=C(C2=C1C=C(C=C2)C#CC3=CC(=C(C=C3)CC(=O)OC)F)C(=O)O)C

Isomeric SMILES

CC1(CC=C(C2=C1C=C(C=C2)C#CC3=CC(=C(C=C3)CC(=O)OC)F)C(=O)O)C

InChI

InChI=1S/C24H21FO4/c1-24(2)11-10-19(23(27)28)18-9-7-15(12-20(18)24)4-5-16-6-8-17(21(25)13-16)14-22(26)29-3/h6-10,12-13H,11,14H2,1-3H3,(H,27,28)