[(2R,3S,5R)-5-indazol-2-yl-3-(4-methylphenyl)carbonyloxy-oxolan-2-yl]methyl 4-methylbenzoate

Systemtic Name: [(2R,3S,5R)-5-indazol-2-yl-3-(4-methylphenyl)carbonyloxy-oxolan-2-yl]methyl 4-methylbenzoate Openeye Name: [(2R,3S,5R)-5-indazol-2-yl-3-(4-methylbenzoyl)oxy-tetrahydrofuran-2-yl]methyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid [(2R,3S,5R)-5-(2-indazolyl)-3-[(4-methylphenyl)-oxomethoxy]-2-oxolanyl]methyl ester IUPAC Name: [(2R,3S,5R)-5-indazol-2-yl-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [(2R,3S,5R)-5-indazol-2-yl-3-p-toluoyloxy-tetrahydrofuran-2-yl]methyl ester Formula: C28H26N2O5 MolecularWeight: 470.51644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCC2C(CC(O2)N3C=C4C=CC=CC4=N3)OC(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC[C@@H]2[C@H](C[C@@H](O2)N3C=C4C=CC=CC4=N3)OC(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C28H26N2O5/c1-18-7-11-20(12-8-18)27(31)33-17-25-24(35-28(32)21-13-9-19(2)10-14-21)15-26(34-25)30-16-22-5-3-4-6-23(22)29-30/h3-14,16,24-26H,15,17H2,1-2H3/t24-,25+,26+/m0/s1