[(2R,3S,4R,5S)-5-[5,6-bis(chloranyl)-1-ethanoyl-2-(phenylmethylsulfanyl)indol-3-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3S,4R,5S)-5-[5,6-bis(chloranyl)-1-ethanoyl-2-(phenylmethylsulfanyl)indol-3-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl ethanoate Openeye Name: [(2R,3S,4R,5S)-5-(1-acetyl-2-benzylsulfanyl-5,6-dichloro-indol-3-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3S,4R,5S)-5-[1-acetyl-5,6-dichloro-2-(phenylmethylthio)-3-indolyl]-3,4-dihydroxy-2-oxolanyl]methyl ester IUPAC Name: [(2R,3S,4R,5S)-5-(1-acetyl-2-benzylsulfanyl-5,6-dichloroindol-3-yl)-3,4-dihydroxyoxolan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3S,4R,5S)-5-[1-acetyl-2-(benzylthio)-5,6-dichloro-indol-3-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl ester Formula: C24H23Cl2NO6S MolecularWeight: 524.41352

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=CC(=C(C=C2C(=C1SCC3=CC=CC=C3)C4C(C(C(O4)COC(=O)C)O)O)Cl)Cl

Isomeric SMILES

CC(=O)N1C2=CC(=C(C=C2C(=C1SCC3=CC=CC=C3)[C@H]4[C@@H]([C@@H]([C@H](O4)COC(=O)C)O)O)Cl)Cl

InChI

InChI=1S/C24H23Cl2NO6S/c1-12(28)27-18-9-17(26)16(25)8-15(18)20(24(27)34-11-14-6-4-3-5-7-14)23-22(31)21(30)19(33-23)10-32-13(2)29/h3-9,19,21-23,30-31H,10-11H2,1-2H3/t19-,21-,22-,23+/m1/s1