(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2,3,4,5,6-pentamethylbenzoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2,3,4,5,6-pentamethylbenzoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2,3,4,5,6-pentamethylbenzoate CAS Name: 2,3,4,5,6-pentamethylbenzoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2,3,4,5,6-pentamethylbenzoate Traditional Name: 2,3,4,5,6-pentamethylbenzoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C21H23ClO4 MolecularWeight: 374.85792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)C(=O)OCC2=C3C(=CC(=C2)Cl)COCO3)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)C(=O)OCC2=C3C(=CC(=C2)Cl)COCO3)C)C

InChI

InChI=1S/C21H23ClO4/c1-11-12(2)14(4)19(15(5)13(11)3)21(23)25-9-17-7-18(22)6-16-8-24-10-26-20(16)17/h6-7H,8-10H2,1-5H3