(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (2R)-2-(4-chlorophenyl)-3-methyl-butanoate

Systemtic Name: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (2R)-2-(4-chlorophenyl)-3-methyl-butanoate Openeye Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (2R)-2-(4-chlorophenyl)-3-methyl-butanoate CAS Name: (2R)-2-(4-chlorophenyl)-3-methylbutanoic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (2R)-2-(4-chlorophenyl)-3-methylbutanoate Traditional Name: (2R)-2-(4-chlorophenyl)-3-methyl-butyric acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C20H20Cl2O4 MolecularWeight: 395.2764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OCC2=CC3=C(C(=C2)Cl)OCCO3

Isomeric SMILES

CC(C)[C@H](C1=CC=C(C=C1)Cl)C(=O)OCC2=CC3=C(C(=C2)Cl)OCCO3

InChI

InChI=1S/C20H20Cl2O4/c1-12(2)18(14-3-5-15(21)6-4-14)20(23)26-11-13-9-16(22)19-17(10-13)24-7-8-25-19/h3-6,9-10,12,18H,7-8,11H2,1-2H3/t18-/m1/s1