[(2R,3S,4S,5R)-2,3,4,5-tetraacetyloxy-5-[3-ethanoyl-5-[[(4-methylphenyl)amino]methyl]-2H-1,3,4-oxadiazol-2-yl]pentyl] ethanoate

Systemtic Name: [(2R,3S,4S,5R)-2,3,4,5-tetraacetyloxy-5-[3-ethanoyl-5-[[(4-methylphenyl)amino]methyl]-2H-1,3,4-oxadiazol-2-yl]pentyl] ethanoate Openeye Name: [(2R,3S,4S,5R)-2,3,4,5-tetraacetoxy-5-[3-acetyl-5-[(4-methylanilino)methyl]-2H-1,3,4-oxadiazol-2-yl]pentyl] acetate CAS Name: acetic acid [(2R,3S,4S,5R)-5-[3-acetyl-5-[(4-methylanilino)methyl]-2H-1,3,4-oxadiazol-2-yl]-2,3,4,5-tetraacetyloxypentyl] ester IUPAC Name: [(2R,3S,4S,5R)-5-[3-acetyl-5-[(4-methylanilino)methyl]-2H-1,3,4-oxadiazol-2-yl]-2,3,4,5-tetraacetyloxypentyl] acetate Traditional Name: acetic acid [(2R,3S,4S,5R)-2,3,4,5-tetraacetoxy-5-[3-acetyl-5-(p-toluidinomethyl)-2H-1,3,4-oxadiazol-2-yl]pentyl] ester Formula: C27H35N3O12 MolecularWeight: 593.5797

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCC2=NN(C(O2)C(C(C(C(COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)NCC2=NN(C(O2)[C@@H]([C@H]([C@H]([C@@H](COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C(=O)C

InChI

InChI=1S/C27H35N3O12/c1-14-8-10-21(11-9-14)28-12-23-29-30(15(2)31)27(42-23)26(41-20(7)36)25(40-19(6)35)24(39-18(5)34)22(38-17(4)33)13-37-16(3)32/h8-11,22,24-28H,12-13H2,1-7H3/t22-,24+,25+,26-,27?/m1/s1