[(2R,3S,4R,5R,6S)-3,4-diacetyloxy-6-[(S)-phenylsulfinyl]-5-[4,5,6,7-tetrakis(chloranyl)-1,3-bis(oxidanylidene)isoindol-2-yl]oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3S,4R,5R,6S)-3,4-diacetyloxy-6-[(S)-phenylsulfinyl]-5-[4,5,6,7-tetrakis(chloranyl)-1,3-bis(oxidanylidene)isoindol-2-yl]oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3S,4R,5R,6S)-3,4-diacetoxy-6-[(S)-phenylsulfinyl]-5-(4,5,6,7-tetrachloro-1,3-dioxo-isoindolin-2-yl)tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3S,4R,5R,6S)-3,4-diacetyloxy-6-[(S)-phenylsulfinyl]-5-(4,5,6,7-tetrachloro-1,3-dioxo-2-isoindolyl)-2-oxanyl]methyl ester IUPAC Name: [(2R,3S,4R,5R,6S)-3,4-diacetyloxy-6-[(S)-phenylsulfinyl]-5-(4,5,6,7-tetrachloro-1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3S,4R,5R,6S)-3,4-diacetoxy-6-[(S)-phenylsulfinyl]-5-(4,5,6,7-tetrachloro-1,3-diketo-isoindolin-2-yl)tetrahydropyran-2-yl]methyl ester Formula: C26H21Cl4NO10S MolecularWeight: 681.32264

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)S(=O)C2=CC=CC=C2)N3C(=O)C4=C(C3=O)C(=C(C(=C4Cl)Cl)Cl)Cl)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)[S@@](=O)C2=CC=CC=C2)N3C(=O)C4=C(C3=O)C(=C(C(=C4Cl)Cl)Cl)Cl)OC(=O)C)OC(=O)C

InChI

InChI=1S/C26H21Cl4NO10S/c1-10(32)38-9-14-22(39-11(2)33)23(40-12(3)34)21(26(41-14)42(37)13-7-5-4-6-8-13)31-24(35)15-16(25(31)36)18(28)20(30)19(29)17(15)27/h4-8,14,21-23,26H,9H2,1-3H3/t14-,21-,22-,23-,26+,42+/m1/s1