methyl 5-chloranyl-4-methoxy-2-(2-methoxyethoxymethoxy)-3-[(E)-6-methoxy-3-methyl-6-oxidanylidene-5-(phenylsulfonyl)hex-2-enyl]benzoate

Systemtic Name: methyl 5-chloranyl-4-methoxy-2-(2-methoxyethoxymethoxy)-3-[(E)-6-methoxy-3-methyl-6-oxidanylidene-5-(phenylsulfonyl)hex-2-enyl]benzoate Openeye Name: methyl 3-[(E)-5-(benzenesulfonyl)-6-methoxy-3-methyl-6-oxo-hex-2-enyl]-5-chloro-4-methoxy-2-(2-methoxyethoxymethoxy)benzoate CAS Name: 3-[(E)-5-(benzenesulfonyl)-6-methoxy-3-methyl-6-oxohex-2-enyl]-5-chloro-4-methoxy-2-(2-methoxyethoxymethoxy)benzoic acid methyl ester IUPAC Name: methyl 3-[(E)-5-(benzenesulfonyl)-6-methoxy-3-methyl-6-oxohex-2-enyl]-5-chloro-4-methoxy-2-(2-methoxyethoxymethoxy)benzoate Traditional Name: 3-[(E)-5-besyl-6-keto-6-methoxy-3-methyl-hex-2-enyl]-5-chloro-4-methoxy-2-(2-methoxyethoxymethoxy)benzoic acid methyl ester Formula: C27H33ClO10S MolecularWeight: 585.06292

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=C(C(=CC(=C1OC)Cl)C(=O)OC)OCOCCOC)CC(C(=O)OC)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C/C(=C\CC1=C(C(=CC(=C1OC)Cl)C(=O)OC)OCOCCOC)/CC(C(=O)OC)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C27H33ClO10S/c1-18(15-23(27(30)36-5)39(31,32)19-9-7-6-8-10-19)11-12-20-24(38-17-37-14-13-33-2)21(26(29)35-4)16-22(28)25(20)34-3/h6-11,16,23H,12-15,17H2,1-5H3/b18-11+