[(3R,4S,5R,6R)-4-acetamido-5,6-diacetyloxy-3-azido-cyclohexen-1-yl]methyl ethanoate

Systemtic Name: [(3R,4S,5R,6R)-4-acetamido-5,6-diacetyloxy-3-azido-cyclohexen-1-yl]methyl ethanoate Openeye Name: [(3R,4S,5R,6R)-4-acetamido-5,6-diacetoxy-3-azido-cyclohexen-1-yl]methyl acetate CAS Name: acetic acid [(3R,4S,5R,6R)-4-acetamido-5,6-diacetyloxy-3-azido-1-cyclohexenyl]methyl ester IUPAC Name: [(3R,4S,5R,6R)-4-acetamido-5,6-diacetyloxy-3-azidocyclohexen-1-yl]methyl acetate Traditional Name: acetic acid [(3R,4S,5R,6R)-4-acetamido-5,6-diacetoxy-3-azido-cyclohexen-1-yl]methyl ester Formula: C15H20N4O7 MolecularWeight: 368.3419

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C=C(C(C1OC(=O)C)OC(=O)C)COC(=O)C)N=[N+]=[N-]

Isomeric SMILES

CC(=O)N[C@H]1[C@@H](C=C([C@H]([C@@H]1OC(=O)C)OC(=O)C)COC(=O)C)N=[N+]=[N-]

InChI

InChI=1S/C15H20N4O7/c1-7(20)17-13-12(18-19-16)5-11(6-24-8(2)21)14(25-9(3)22)15(13)26-10(4)23/h5,12-15H,6H2,1-4H3,(H,17,20)/t12-,13+,14-,15-/m1/s1