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

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 1-phenylcyclopentane-1-carboxylate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 1-phenylcyclopentanecarboxylate CAS Name: 1-phenyl-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-phenylcyclopentane-1-carboxylate Traditional Name: 1-phenylcyclopentanecarboxylic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C21H21ClO4 MolecularWeight: 372.84204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClO4/c22-18-10-15-12-24-14-26-19(15)16(11-18)13-25-20(23)21(8-4-5-9-21)17-6-2-1-3-7-17/h1-3,6-7,10-11H,4-5,8-9,12-14H2