2-methylpropyl 2-acetyloxy-5-[(E)-2-(4-chloranylsulfonylphenyl)ethenyl]benzoate

Systemtic Name: 2-methylpropyl 2-acetyloxy-5-[(E)-2-(4-chloranylsulfonylphenyl)ethenyl]benzoate Openeye Name: isobutyl 2-acetoxy-5-[(E)-2-(4-chlorosulfonylphenyl)vinyl]benzoate CAS Name: 2-acetyloxy-5-[(E)-2-(4-chlorosulfonylphenyl)ethenyl]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-acetyloxy-5-[(E)-2-(4-chlorosulfonylphenyl)ethenyl]benzoate Traditional Name: 2-acetoxy-5-[(E)-2-(4-chlorosulfonylphenyl)vinyl]benzoic acid isobutyl ester Formula: C21H21ClO6S MolecularWeight: 436.90584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=C(C=CC(=C1)C=CC2=CC=C(C=C2)S(=O)(=O)Cl)OC(=O)C

Isomeric SMILES

CC(C)COC(=O)C1=C(C=CC(=C1)/C=C/C2=CC=C(C=C2)S(=O)(=O)Cl)OC(=O)C

InChI

InChI=1S/C21H21ClO6S/c1-14(2)13-27-21(24)19-12-17(8-11-20(19)28-15(3)23)5-4-16-6-9-18(10-7-16)29(22,25)26/h4-12,14H,13H2,1-3H3/b5-4+