(5,7-ditert-butyl-3-oxidanyl-2,3-dihydro-1,4-benzodioxin-2-yl) 3-chloranylbenzoate

Systemtic Name: (5,7-ditert-butyl-3-oxidanyl-2,3-dihydro-1,4-benzodioxin-2-yl) 3-chloranylbenzoate Openeye Name: (5,7-ditert-butyl-3-hydroxy-2,3-dihydro-1,4-benzodioxin-2-yl) 3-chlorobenzoate CAS Name: 3-chlorobenzoic acid (5,7-ditert-butyl-3-hydroxy-2,3-dihydro-1,4-benzodioxin-2-yl) ester IUPAC Name: (5,7-ditert-butyl-3-hydroxy-2,3-dihydro-1,4-benzodioxin-2-yl) 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid (5,7-ditert-butyl-3-hydroxy-2,3-dihydro-1,4-benzodioxin-2-yl) ester Formula: C23H27ClO5 MolecularWeight: 418.91048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C1)OC(C(O2)O)OC(=O)C3=CC(=CC=C3)Cl)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C1)OC(C(O2)O)OC(=O)C3=CC(=CC=C3)Cl)C(C)(C)C

InChI

InChI=1S/C23H27ClO5/c1-22(2,3)14-11-16(23(4,5)6)18-17(12-14)27-21(20(26)28-18)29-19(25)13-8-7-9-15(24)10-13/h7-12,20-21,26H,1-6H3