[(2S,3S,4R,5R,6S)-4-acetyloxy-5-benzamido-2-(butylsulfamoylmethyl)-6-methoxy-oxan-3-yl] ethanoate

Systemtic Name: [(2S,3S,4R,5R,6S)-4-acetyloxy-5-benzamido-2-(butylsulfamoylmethyl)-6-methoxy-oxan-3-yl] ethanoate Openeye Name: [(2S,3S,4R,5R,6S)-4-acetoxy-5-benzamido-2-(butylsulfamoylmethyl)-6-methoxy-tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2S,3S,4R,5R,6S)-4-acetyloxy-5-benzamido-2-(butylsulfamoylmethyl)-6-methoxy-3-oxanyl] ester IUPAC Name: [(2S,3S,4R,5R,6S)-4-acetyloxy-5-benzamido-2-(butylsulfamoylmethyl)-6-methoxyoxan-3-yl] acetate Traditional Name: acetic acid [(2S,3S,4R,5R,6S)-4-acetoxy-5-benzamido-2-(butylsulfamoylmethyl)-6-methoxy-tetrahydropyran-3-yl] ester Formula: C22H32N2O9S MolecularWeight: 500.56248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)CC1C(C(C(C(O1)OC)NC(=O)C2=CC=CC=C2)OC(=O)C)OC(=O)C

Isomeric SMILES

CCCCNS(=O)(=O)C[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC)NC(=O)C2=CC=CC=C2)OC(=O)C)OC(=O)C

InChI

InChI=1S/C22H32N2O9S/c1-5-6-12-23-34(28,29)13-17-19(31-14(2)25)20(32-15(3)26)18(22(30-4)33-17)24-21(27)16-10-8-7-9-11-16/h7-11,17-20,22-23H,5-6,12-13H2,1-4H3,(H,24,27)/t17-,18-,19-,20-,22+/m1/s1