(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 1-(4-fluorophenyl)cyclopentane-1-carboxylate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 1-(4-fluorophenyl)cyclopentane-1-carboxylate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 1-(4-fluorophenyl)cyclopentanecarboxylate CAS Name: 1-(4-fluorophenyl)-1-cyclopentanecarboxylic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 1-(4-fluorophenyl)cyclopentane-1-carboxylate Traditional Name: 1-(4-fluorophenyl)cyclopentanecarboxylic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C21H20ClFO4 MolecularWeight: 390.832503

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC=C(C=C2)F)C(=O)OCC3=C4C(=CC(=C3)Cl)COCO4

Isomeric SMILES

C1CCC(C1)(C2=CC=C(C=C2)F)C(=O)OCC3=C4C(=CC(=C3)Cl)COCO4

InChI

InChI=1S/C21H20ClFO4/c22-17-9-14-11-25-13-27-19(14)15(10-17)12-26-20(24)21(7-1-2-8-21)16-3-5-18(23)6-4-16/h3-6,9-10H,1-2,7-8,11-13H2