tert-butyl (3S)-3-(furan-2-ylcarbonyloxymethyl)-3-(hydroxymethyl)-5-methoxy-2-oxidanylidene-indole-1-carboxylate

Systemtic Name: tert-butyl (3S)-3-(furan-2-ylcarbonyloxymethyl)-3-(hydroxymethyl)-5-methoxy-2-oxidanylidene-indole-1-carboxylate Openeye Name: tert-butyl (3S)-3-(furan-2-carbonyloxymethyl)-3-(hydroxymethyl)-5-methoxy-2-oxo-indoline-1-carboxylate CAS Name: (3S)-3-[[2-furanyl(oxo)methoxy]methyl]-3-(hydroxymethyl)-5-methoxy-2-oxo-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-3-(furan-2-carbonyloxymethyl)-3-(hydroxymethyl)-5-methoxy-2-oxoindole-1-carboxylate Traditional Name: (3S)-3-(2-furoyloxymethyl)-2-keto-5-methoxy-3-methylol-indoline-1-carboxylic acid tert-butyl ester Formula: C21H23NO8 MolecularWeight: 417.40922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)OC)C(C1=O)(CO)COC(=O)C3=CC=CO3

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)OC)[C@](C1=O)(CO)COC(=O)C3=CC=CO3

InChI

InChI=1S/C21H23NO8/c1-20(2,3)30-19(26)22-15-8-7-13(27-4)10-14(15)21(11-23,18(22)25)12-29-17(24)16-6-5-9-28-16/h5-10,23H,11-12H2,1-4H3/t21-/m0/s1