(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 1-(3-fluorophenyl)cyclopentane-1-carboxylate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 1-(3-fluorophenyl)cyclopentane-1-carboxylate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 1-(3-fluorophenyl)cyclopentanecarboxylate CAS Name: 1-(3-fluorophenyl)-1-cyclopentanecarboxylic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 1-(3-fluorophenyl)cyclopentane-1-carboxylate Traditional Name: 1-(3-fluorophenyl)cyclopentanecarboxylic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C24H23FO4 MolecularWeight: 394.435423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3(CCCC3)C4=CC(=CC=C4)F)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3(CCCC3)C4=CC(=CC=C4)F)C

InChI

InChI=1S/C24H23FO4/c1-15-8-9-20-17(12-21(26)29-22(20)16(15)2)14-28-23(27)24(10-3-4-11-24)18-6-5-7-19(25)13-18/h5-9,12-13H,3-4,10-11,14H2,1-2H3