[(2S,3S,4R,5R,6S)-5-acetamido-2-(fluoranylmethyl)-6-methoxy-3-oxidanyl-oxan-4-yl] 2-(4-acetamidophenyl)ethanoate

Systemtic Name: [(2S,3S,4R,5R,6S)-5-acetamido-2-(fluoranylmethyl)-6-methoxy-3-oxidanyl-oxan-4-yl] 2-(4-acetamidophenyl)ethanoate Openeye Name: [(2S,3S,4R,5R,6S)-5-acetamido-2-(fluoromethyl)-3-hydroxy-6-methoxy-tetrahydropyran-4-yl] 2-(4-acetamidophenyl)acetate CAS Name: 2-(4-acetamidophenyl)acetic acid [(2S,3S,4R,5R,6S)-5-acetamido-2-(fluoromethyl)-3-hydroxy-6-methoxy-4-oxanyl] ester IUPAC Name: [(2S,3S,4R,5R,6S)-5-acetamido-2-(fluoromethyl)-3-hydroxy-6-methoxyoxan-4-yl] 2-(4-acetamidophenyl)acetate Traditional Name: 2-(4-acetamidophenyl)acetic acid [(2S,3S,4R,5R,6S)-5-acetamido-2-(fluoromethyl)-3-hydroxy-6-methoxy-tetrahydropyran-4-yl] ester Formula: C19H25FN2O7 MolecularWeight: 412.409403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1OC)CF)O)OC(=O)CC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1OC)CF)O)OC(=O)CC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C19H25FN2O7/c1-10(23)21-13-6-4-12(5-7-13)8-15(25)29-18-16(22-11(2)24)19(27-3)28-14(9-20)17(18)26/h4-7,14,16-19,26H,8-9H2,1-3H3,(H,21,23)(H,22,24)/t14-,16-,17-,18-,19+/m1/s1